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3-(3-nitro-1H-1,2,4-triazol-1-yl)-N-phenyl-1-adamantanecarboxamide

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3-(3-nitro-1H-1,2,4-triazol-1-yl)-N-phenyl-1-adamantanecarboxamide
SpectraBase Compound ID KIdRYMDFAp2
InChI InChI=1S/C19H21N5O3/c25-16(21-15-4-2-1-3-5-15)18-7-13-6-14(8-18)10-19(9-13,11-18)23-12-20-17(22-23)24(26)27/h1-5,12-14H,6-11H2,(H,21,25)/t13-,14+,18+,19-
InChIKey CKWFVLVSGXQXGL-BZUPMSHVSA-N
Mol Weight 367.41 g/mol
Molecular Formula C19H21N5O3
Exact Mass 367.16444 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I0lqNpmmBey
Name 3-(3-nitro-1H-1,2,4-triazol-1-yl)-N-phenyl-1-adamantanecarboxamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C19H21N5O3/c25-16(21-15-4-2-1-3-5-15)18-7-13-6-14(8-18)10-19(9-13,11-18)23-12-20-17(22-23)24(26)27/h1-5,12-14H,6-11H2,(H,21,25)/t13-,14+,18+,19-
InChIKey CKWFVLVSGXQXGL-BZUPMSHVSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_19779
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/9150101; UBI_ID: UBI-019783
Temperature 308 °C