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5H-Pyrrolo[1,2-c]thiazolium, 6,7-dihydro-1-mercapto-3-phenyl-, hydroxide, inner salt
SpectraBase Compound ID 8c5brP1GIjm
InChI InChI=1S/C12H11NS2/c14-12-10-7-4-8-13(10)11(15-12)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2
InChIKey QQTFZSMSWVVKBO-UHFFFAOYSA-N
Mol Weight 233.35 g/mol
Molecular Formula C12H11NS2
Exact Mass 233.033292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1EkVwWSJ0K
Name 5H-Pyrrolo[1,2-c]thiazolium, 6,7-dihydro-1-mercapto-3-phenyl-, hydroxide, inner salt
CAS Registry Number 24053-37-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11NS2
InChI InChI=1S/C12H11NS2/c14-12-10-7-4-8-13(10)11(15-12)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2
InChIKey QQTFZSMSWVVKBO-UHFFFAOYSA-N
Molecular Weight 233.347 g/mol
SMILES c1([n+]2c(c(s1)[S-])CCC2)-c1ccccc1
SPLASH splash10-0089-0690000000-634bc999ba102680b32a
Source of Spectrum F-32-580-0
Synonyms 3-Phenyl-6,7-dihydro-5H-pyrrolo[1,2-c][1,3]thiazol-4-ium-1-thiolate 3-Phenyl-6,7-dihydro-5H-pyrrolo[1,2-c][1,3]thiazol-4-ium-1-ylsulfide Anhydro-5-monosulfur-2-phenyl-3,4-trimethylene-thiazoliumhydroxide
Wiley ID 1234804