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benzoic acid, 4-[5-[(2-ethoxy-2-oxoethyl)thio]-1H-tetrazol-1-yl]-, 2-[(3-hydroxyphenyl)amino]-2-oxoethyl ester
SpectraBase Compound ID 9AS0ze810BB
InChI InChI=1S/C20H19N5O6S/c1-2-30-18(28)12-32-20-22-23-24-25(20)15-8-6-13(7-9-15)19(29)31-11-17(27)21-14-4-3-5-16(26)10-14/h3-10,26H,2,11-12H2,1H3,(H,21,27)
InChIKey JCACUYUNGBCEHM-UHFFFAOYSA-N
Mol Weight 457.46 g/mol
Molecular Formula C20H19N5O6S
Exact Mass 457.105605 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GReGbS8vTee
Name benzoic acid, 4-[5-[(2-ethoxy-2-oxoethyl)thio]-1H-tetrazol-1-yl]-, 2-[(3-hydroxyphenyl)amino]-2-oxoethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 457.105604520 u
Formula C20H19N5O6S
InChI InChI=1S/C20H19N5O6S/c1-2-30-18(28)12-32-20-22-23-24-25(20)15-8-6-13(7-9-15)19(29)31-11-17(27)21-14-4-3-5-16(26)10-14/h3-10,26H,2,11-12H2,1H3,(H,21,27)
InChIKey JCACUYUNGBCEHM-UHFFFAOYSA-N
Molecular Weight 457.461 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17455
Solvent DMSO-d6
Source Vendor ID: NMR/10311357; Lab Info: LP; Lab Number: LP-3701291