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3-Phenyl-1,2,4-triazole-5-thiol hydrate
SpectraBase Compound ID wLSoy21PLV
InChI InChI=1S/C8H7N3S.H2O/c12-8-9-7(10-11-8)6-4-2-1-3-5-6;/h1-5H,(H2,9,10,11,12);1H2
InChIKey MLDZORJKIKBMKW-UHFFFAOYSA-N
Mol Weight 195.24 g/mol
Molecular Formula C8H9N3OS
Exact Mass 195.046633 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID LWqD2Y8bvJt
Name 3-Phenyl-1,2,4-triazole-5-thiol hydrate
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Catalog Number A12427
Lot Number 10113731
CAS Registry Number 3414-94-6
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H9N3OS
InChI InChI=1S/C8H7N3S.H2O/c12-8-9-7(10-11-8)6-4-2-1-3-5-6;/h1-5H,(H2,9,10,11,12);1H2
InChIKey MLDZORJKIKBMKW-UHFFFAOYSA-N
Instrument Name Bruker MultiRAM Stand Alone FT-Raman Spectrometer
Physical State Solid
Purity 98%
Raman Corrections Referenced to internal white light source; Scattering corrected
Raman Laser Source Nd:YAG
Sample Type Organic
Source of Spectrum Bio-Rad Laboratories, Inc.
Synonyms 3-Mercapto-5-phenyl-1,2,4-triazole hydrate
Technique FT-Raman