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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

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9DgMsVUMqZd
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 © 1991-2024 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
Instrument Name BRUKER AC-300
Melting Point 101-104C
Molecular Weight 312.78
Solvent Polysol; Reference=TMS; Temperature 297K