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N-[4-(1,3-benzoxazol-2-yl)phenyl]-N'-(3-iodobenzoyl)thiourea
SpectraBase Compound ID K7tpuFBFVz6
InChI InChI=1S/C21H14IN3O2S/c22-15-5-3-4-14(12-15)19(26)25-21(28)23-16-10-8-13(9-11-16)20-24-17-6-1-2-7-18(17)27-20/h1-12H,(H2,23,25,26,28)
InChIKey MGRXWOSKQQYFEI-UHFFFAOYSA-N
Mol Weight 499.33 g/mol
Molecular Formula C21H14IN3O2S
Exact Mass 498.985143 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3NSkATDxBaY
Name N-[4-(1,3-benzoxazol-2-yl)phenyl]-N'-(3-iodobenzoyl)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/C21H14IN3O2S/c22-15-5-3-4-14(12-15)19(26)25-21(28)23-16-10-8-13(9-11-16)20-24-17-6-1-2-7-18(17)27-20/h1-12H,(H2,23,25,26,28)
InChIKey MGRXWOSKQQYFEI-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_5538
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: D22931; Labnumber: SPMOS1-22530; SBI_ID: SBI-005540
Temperature 318 °C