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5-{[(p-chlorophenyl)thio]methyl}-2H-tetrazole-2-acetic acid, ethyl ester

View entire compound with spectra: 3 NMR, and 1 FTIR

5-{[(p-chlorophenyl)thio]methyl}-2H-tetrazole-2-acetic acid, ethyl ester
SpectraBase Compound ID 70V9BMQVHv9
InChI InChI=1S/C12H13ClN4O2S/c1-2-19-12(18)7-17-15-11(14-16-17)8-20-10-5-3-9(13)4-6-10/h3-6H,2,7-8H2,1H3
InChIKey ANRLKUDJHSMDSM-UHFFFAOYSA-N
Mol Weight 312.78 g/mol
Molecular Formula C12H13ClN4O2S
Exact Mass 312.044775 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID Lq5yiLG8wHz
Name 5-{[(p-CHLOROPHENYL)THIO]METHYL}-2H-TETRAZOLE-2-ACETIC ACID, ETHYL ESTER
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13ClN4O2S
InChI InChI=1S/C12H13ClN4O2S/c1-2-19-12(18)7-17-15-11(14-16-17)8-20-10-5-3-9(13)4-6-10/h3-6H,2,7-8H2,1H3
InChIKey ANRLKUDJHSMDSM-UHFFFAOYSA-N
Melting Point 101-104C
Molecular Weight 312.772003
Synonyms 2H-TETRAZOLE-2-ACETIC ACID, 5-///P-CHLOROPHENYL/THIO/METHYL/-, ETHYL ESTER
Technique KBr WAFER