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1H-1,2,3-benzotriazole-1-acetamide, N-[4-(cyanomethyl)phenyl]-
SpectraBase Compound ID 4yXgHziGf9R
InChI InChI=1S/C16H13N5O/c17-10-9-12-5-7-13(8-6-12)18-16(22)11-21-15-4-2-1-3-14(15)19-20-21/h1-8H,9,11H2,(H,18,22)
InChIKey VYBAQTOBMZSNCV-UHFFFAOYSA-N
Mol Weight 291.31 g/mol
Molecular Formula C16H13N5O
Exact Mass 291.11201 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4vqFW7IYzRZ
Name 1H-1,2,3-benzotriazole-1-acetamide, N-[4-(cyanomethyl)phenyl]-
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/C16H13N5O/c17-10-9-12-5-7-13(8-6-12)18-16(22)11-21-15-4-2-1-3-14(15)19-20-21/h1-8H,9,11H2,(H,18,22)
InChIKey VYBAQTOBMZSNCV-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_4868
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: NMR/12210957; Labnumber: PNA-0000310