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1,2,3-Thiadiazolium, 5-hydroxy-3-methyl-4-phenyl-, hydroxide, inner salt

View entire compound with spectra: 1 MS (GC)

1,2,3-Thiadiazolium, 5-hydroxy-3-methyl-4-phenyl-, hydroxide, inner salt
SpectraBase Compound ID 7TyZ6ZZTOYk
InChI InChI=1S/C9H8N2OS/c1-11-8(9(12)13-10-11)7-5-3-2-4-6-7/h2-6H,1H3
InChIKey LKQWAAFYPSHIDP-UHFFFAOYSA-N
Mol Weight 192.24 g/mol
Molecular Formula C9H8N2OS
Exact Mass 192.035734 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8fDgxB309il
Name 1,2,3-Thiadiazolium, 5-hydroxy-3-methyl-4-phenyl-, hydroxide, inner salt
Alternate Name(s) 3-Methyl-4-phenyl-1,2,3-thiadiazol-3-ium-5-olate 3-Methyl-4-phenyl-1,2,3-thiadiazolium-5-olate
CAS Registry Number 71331-55-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8N2OS
InChI InChI=1S/C9H8N2OS/c1-11-8(9(12)13-10-11)7-5-3-2-4-6-7/h2-6H,1H3
InChIKey LKQWAAFYPSHIDP-UHFFFAOYSA-N
Molecular Weight 192.236 g/mol
SMILES c1([n+](nsc1[O-])C)-c1ccccc1
SPLASH splash10-0006-1900000000-0f182301cfa9cc5e8dc3
Source of Spectrum KC-1979-958-0
Wiley ID 1188044