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2H-1,4-benzoxazin-3(4H)-one

Compound with spectra: 6 NMR, 4 FTIR, 2 Raman, and 5 MS (GC)

2H-1,4-benzoxazin-3(4H)-one
SpectraBase Compound ID Id3khVug9Ik
InChI InChI=1S/C8H7NO2/c10-8-5-11-7-4-2-1-3-6(7)9-8/h1-4H,5H2,(H,9,10)
InChIKey QRCGFTXRXYMJOS-UHFFFAOYSA-N
Mol Weight 149.15 g/mol
Molecular Formula C8H7NO2
Exact Mass 149.047678 g/mol

View Spectrum of 2H-1,4-benzoxazin-3(4H)-one

ATR-IR Spectrum
Copyright Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Company LLC
Source of Spectrum Forensic Spectral Research
Catalog Number <a href=https://www.sigmaaldrich.com/US/en/product/aldrich/383503>383503</a>

View Spectrum of 2H-1,4-benzoxazin-3(4H)-one

ATR-IR Spectrum
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Indofine Chemical Company, Inc.
Source of Spectrum Forensic Spectral Research
Catalog Number 17-017

View Spectrum of 2H-1,4-benzoxazin-3(4H)-one

ATR-IR Spectrum
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Catalog Number 383503

View Spectrum of 2H-1,4-benzoxazin-3(4H)-one

13C NMR Spectrum
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent DMSO-D6

View Spectrum of 2H-1,4-benzoxazin-3(4H)-one

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6;C=0.6M

View Spectrum of 2H-1,4-benzoxazin-3(4H)-one

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.

View Spectrum of 2H-1,4-benzoxazin-3(4H)-one

13C NMR Spectrum
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 383503
Solvent DMSO-d6

View Spectrum of 2H-1,4-benzoxazin-3(4H)-one

1H NMR Spectrum
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
Solvent DMSO-d6

View Spectrum of 2H-1,4-benzoxazin-3(4H)-one

1H NMR Spectrum
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 383503
Solvent DMSO-d6

View Spectrum of 2H-1,4-benzoxazin-3(4H)-one

Raman Spectrum
Copyright Copyright © 2014-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Indofine Chemical Company, Inc.
Source of Spectrum Forensic Spectral Research
Catalog Number 17-017

View Spectrum of 2H-1,4-benzoxazin-3(4H)-one

Raman Spectrum
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Company LLC
Source of Spectrum Forensic Spectral Research
Catalog Number <a href=https://www.sigmaaldrich.com/US/en/product/aldrich/383503>383503</a>

View Spectrum of 2H-1,4-benzoxazin-3(4H)-one

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum O-3-112-5

View Spectrum of 2H-1,4-benzoxazin-3(4H)-one

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum EK-1999-816-0

View Spectrum of 2H-1,4-benzoxazin-3(4H)-one

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum EK-1999-817-0

View Spectrum of 2H-1,4-benzoxazin-3(4H)-one

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum F-67-1190-3a

View Spectrum of 2H-1,4-benzoxazin-3(4H)-one

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum IC-227-0-0

View Spectrum of 2H-1,4-benzoxazin-3(4H)-one

FTIR Spectrum
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 383503
Technique Mull
  • 2H-1,4-Benzoxazin-3(H)-one
  • QRCGFTXRXYMJOS-UHFFFAOYSA-N
  • 1,4(2H)-BENZOXAZIN-3(4H)-ONE
  • 3,4-Dihydro-2H-1,4-benzoxazine-3-one
2-chloro-N-(2-ethoxyphenyl)acetamide
N-[2-(3-hydroxypropoxy)phenyl]acetamide
Acetamide, N-[2-(3-butenyloxy)phenyl]-
N-(2-(3-cyanopropoxy)phenyl)acetamide
Acetamide, N-[2-(4-pentenyloxy)phenyl]-
3-{[3-(2-methoxyanilino)-3-oxopropyl]sulfanyl}-N-(2-methoxyphenyl)propanamide
o-Acetoacetanisidide
Acetamide, 2-(2-fluorophenoxy)-N-(4-fluorophenyl)-
Acetamide, N-(4-bromophenyl)-2-(2-chlorophenoxy)-
N-[2-(Trifluoromethoxy)phenyl]acetamide
Title Journal or Book Year
Deuterium-induced carbon-13 isotope shifts in nitrogen-containing benzoheterocyclic systems Magnetic Resonance in Chemistry 1999

This compound is available in the following databases:

Wiley Registry of Mass Spectral Data 2023
Author: Wiley

The foundation library for any analytical laboratory running mass spectrometry, the Wiley Registry provides the broadest coverage available in any mass spectral library Learn more.

Vendor/Supplier Catalog Number
Sigma-Aldrich Company LLC
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