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Carbonothioic acid, S-[1-(3-methoxyphenyl)-1H-tetrazol-5-yl]O-propyl ester
SpectraBase Compound ID 4bVIYAGq1Tk
InChI InChI=1S/C12H14N4O3S/c1-3-7-19-12(17)20-11-13-14-15-16(11)9-5-4-6-10(8-9)18-2/h4-6,8H,3,7H2,1-2H3
InChIKey OIDFKMMACUJCIL-UHFFFAOYSA-N
Mol Weight 294.33 g/mol
Molecular Formula C12H14N4O3S
Exact Mass 294.078661 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JQHKS10WieZ
Name Carbonothioic acid, S-[1-(3-methoxyphenyl)-1H-tetrazol-5-yl]O-propyl ester
Alternate Name(s) S-1-(3-methoxyphenyl)tetrazol-5-yl-mono-thiocarbonic acid propyl ester S-[1-(3-methoxyphenyl)-1H-tetraazol-5-yl]O-propyl thiocarbonate
CAS Registry Number 74940-18-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14N4O3S
InChI InChI=1S/C12H14N4O3S/c1-3-7-19-12(17)20-11-13-14-15-16(11)9-5-4-6-10(8-9)18-2/h4-6,8H,3,7H2,1-2H3
InChIKey OIDFKMMACUJCIL-UHFFFAOYSA-N
Molecular Weight 294.329 g/mol
SMILES c1([n](nnn1)-c1cc(OC)ccc1)SC(=O)OCCC
SPLASH splash10-000t-0900000000-0249ff8153c1a4d87533
Source of Spectrum O-15-168-1
Wiley ID 1296755