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Carbonothioic acid, S-[1-(4-chlorophenyl)-1H-tetrazol-5-yl]O-propyl ester
SpectraBase Compound ID 1DnlyfftSmr
InChI InChI=1S/C11H11ClN4O2S/c1-2-7-18-11(17)19-10-13-14-15-16(10)9-5-3-8(12)4-6-9/h3-6H,2,7H2,1H3
InChIKey UVIKDANMGWSAJX-UHFFFAOYSA-N
Mol Weight 298.75 g/mol
Molecular Formula C11H11ClN4O2S
Exact Mass 298.029124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 572I5vHCN0A
Name Carbonothioic acid, S-[1-(4-chlorophenyl)-1H-tetrazol-5-yl]O-propyl ester
CAS Registry Number 74940-20-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11ClN4O2S
InChI InChI=1S/C11H11ClN4O2S/c1-2-7-18-11(17)19-10-13-14-15-16(10)9-5-3-8(12)4-6-9/h3-6H,2,7H2,1H3
InChIKey UVIKDANMGWSAJX-UHFFFAOYSA-N
Molecular Weight 298.748 g/mol
SMILES c1([n](nnn1)-c1ccc(cc1)Cl)SC(=O)OCCC
SPLASH splash10-0udi-0900000000-7a779b5928d4e3d03e58
Source of Spectrum O-15-168-1
Synonyms S-1-(4-chlorophenyl)tetrazol-5-yl-mono-thiocarbonic acid propyl ester S-[1-(4-chlorophenyl)-1H-tetraazol-5-yl]O-propyl thiocarbonate
Wiley ID 1300500