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butanoic acid, 4-[[3-methyl-4-(1H-tetrazol-1-yl)phenyl]amino]-4-oxo-
SpectraBase Compound ID D7l8fdjp2PX
InChI InChI=1S/C12H13N5O3/c1-8-6-9(14-11(18)4-5-12(19)20)2-3-10(8)17-7-13-15-16-17/h2-3,6-7H,4-5H2,1H3,(H,14,18)(H,19,20)
InChIKey PYHAVKILZVCJPM-UHFFFAOYSA-N
Mol Weight 275.27 g/mol
Molecular Formula C12H13N5O3
Exact Mass 275.101839 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2IutYGytavP
Name butanoic acid, 4-[[3-methyl-4-(1H-tetrazol-1-yl)phenyl]amino]-4-oxo-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 275.101839296 u
Formula C12H13N5O3
InChI InChI=1S/C12H13N5O3/c1-8-6-9(14-11(18)4-5-12(19)20)2-3-10(8)17-7-13-15-16-17/h2-3,6-7H,4-5H2,1H3,(H,14,18)(H,19,20)
InChIKey PYHAVKILZVCJPM-UHFFFAOYSA-N
Molecular Weight 275.268 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_8350
Solvent DMSO-d6
Source Vendor ID: NMR/13309271