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benzoic acid, 4-[5-[(2-ethoxy-2-oxoethyl)thio]-1H-tetrazol-1-yl]-
SpectraBase Compound ID 7z6VaYuJvY6
InChI InChI=1S/C12H12N4O4S/c1-2-20-10(17)7-21-12-13-14-15-16(12)9-5-3-8(4-6-9)11(18)19/h3-6H,2,7H2,1H3,(H,18,19)
InChIKey OBYAPZNXTSYATC-UHFFFAOYSA-N
Mol Weight 308.31 g/mol
Molecular Formula C12H12N4O4S
Exact Mass 308.057926 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID D9vkXL2G5cH
Name benzoic acid, 4-[5-[(2-ethoxy-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 308.057926052 u
Formula C12H12N4O4S
InChI InChI=1S/C12H12N4O4S/c1-2-20-10(17)7-21-12-13-14-15-16(12)9-5-3-8(4-6-9)11(18)19/h3-6H,2,7H2,1H3,(H,18,19)
InChIKey OBYAPZNXTSYATC-UHFFFAOYSA-N
Molecular Weight 308.312 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1838
Solvent DMSO-d6
Source Vendor ID: ZI/8167029; Lab Info: LP; Lab Number: LP-3700542
Temperature 29.85 °C