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benzoic acid, 4-[5-[[2-[(1,1-dimethylethyl)amino]-2-oxoethyl]thio]-1H-tetrazol-1-yl]-
SpectraBase Compound ID 3okcufPfdP1
InChI InChI=1S/C14H17N5O3S/c1-14(2,3)15-11(20)8-23-13-16-17-18-19(13)10-6-4-9(5-7-10)12(21)22/h4-7H,8H2,1-3H3,(H,15,20)(H,21,22)
InChIKey IPUBATLPLYJJEA-UHFFFAOYSA-N
Mol Weight 335.38 g/mol
Molecular Formula C14H17N5O3S
Exact Mass 335.105211 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ha61yVV08uO
Name benzoic acid, 4-[5-[[2-[(1,1-dimethylethyl)amino]-2-oxoethyl]thio]-1H-tetrazol-1-yl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.105210598 u
Formula C14H17N5O3S
InChI InChI=1S/C14H17N5O3S/c1-14(2,3)15-11(20)8-23-13-16-17-18-19(13)10-6-4-9(5-7-10)12(21)22/h4-7H,8H2,1-3H3,(H,15,20)(H,21,22)
InChIKey IPUBATLPLYJJEA-UHFFFAOYSA-N
Molecular Weight 335.382 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1842
Solvent DMSO-d6
Source Vendor ID: ZI/8169783; Lab Info: LP; Lab Number: LP-3700560
Temperature 29.85 °C