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2-Phenyl-1,2-dihydro-3H-1,2,4-triazole-3-thione

View entire compound with spectra: 1 MS (GC)

2-Phenyl-1,2-dihydro-3H-1,2,4-triazole-3-thione
SpectraBase Compound ID JTJinyEJUAn
InChI InChI=1S/C8H7N3S/c12-8-9-6-10-11(8)7-4-2-1-3-5-7/h1-6H,(H,9,10,12)
InChIKey BVIRJZRMLOIHQT-UHFFFAOYSA-N
Mol Weight 177.22 g/mol
Molecular Formula C8H7N3S
Exact Mass 177.036068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IUMENQ62S5J
Name 2-Phenyl-1,2-dihydro-3H-1,2,4-triazole-3-thione
Alternate Name(s) 2-Phenyl-1H-1,2,4-triazole-3-thione 3H-1,2,4-Triazole-3-thione, 1,2-dihydro-2-phenyl-
CAS Registry Number 21434-18-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7N3S
InChI InChI=1S/C8H7N3S/c12-8-9-6-10-11(8)7-4-2-1-3-5-7/h1-6H,(H,9,10,12)
InChIKey BVIRJZRMLOIHQT-UHFFFAOYSA-N
Molecular Weight 177.225 g/mol
SMILES Sc1ncn[n]1-c1ccccc1
SPLASH splash10-004i-9700000000-66c32afc84702015bca3
Source of Spectrum W5-0-0-0
Wiley ID 1173028