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Carbonothioic acid, S-(1-phenyl-1H-tetrazol-5-yl) O-propyl ester
SpectraBase Compound ID 1xoGwFp9RqZ
InChI InChI=1S/C11H12N4O2S/c1-2-8-17-11(16)18-10-12-13-14-15(10)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3
InChIKey HGJHLLPNXLAIAS-UHFFFAOYSA-N
Mol Weight 264.3 g/mol
Molecular Formula C11H12N4O2S
Exact Mass 264.068097 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3TO2GCxrrbs
Name Carbonothioic acid, S-(1-phenyl-1H-tetrazol-5-yl) O-propyl ester
Alternate Name(s) S-(1-phenyl)tetrazol-5-yl-monothiocarbonic acid propyl ester S-(1-phenyl-1H-tetraazol-5-yl) O-propyl thiocarbonate
CAS Registry Number 74940-16-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12N4O2S
InChI InChI=1S/C11H12N4O2S/c1-2-8-17-11(16)18-10-12-13-14-15(10)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3
InChIKey HGJHLLPNXLAIAS-UHFFFAOYSA-N
Molecular Weight 264.303 g/mol
SMILES c1([n](nnn1)-c1ccccc1)SC(=O)OCCC
SPLASH splash10-0699-0900000000-bf56fe63e5ff23d570a8
Source of Spectrum O-15-168-1
Wiley ID 1267476