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N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]-N'-(3-propoxybenzoyl)thiourea
SpectraBase Compound ID Az4BC56a7iF
InChI InChI=1S/C28H29N3O3S/c1-5-15-33-22-8-6-7-19(16-22)25(32)31-27(35)29-21-13-14-24-23(17-21)30-26(34-24)18-9-11-20(12-10-18)28(2,3)4/h6-14,16-17H,5,15H2,1-4H3,(H2,29,31,32,35)
InChIKey TXERKVWTCIOTOL-UHFFFAOYSA-N
Mol Weight 487.62 g/mol
Molecular Formula C28H29N3O3S
Exact Mass 487.192963 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GvEtMXiFoP4
Name N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]-N'-(3-propoxybenzoyl)thiourea
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/C28H29N3O3S/c1-5-15-33-22-8-6-7-19(16-22)25(32)31-27(35)29-21-13-14-24-23(17-21)30-26(34-24)18-9-11-20(12-10-18)28(2,3)4/h6-14,16-17H,5,15H2,1-4H3,(H2,29,31,32,35)
InChIKey TXERKVWTCIOTOL-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_6677
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: 63098; UBI_ID: UBI-006679
Temperature 315 °C