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3,3a,4,5,6,7-HEXAHYDRO-3-HYDROXYTHIO-3-(TRIFLUOROMETHYL)-2H-INDAZOLE-2-CARBOXAMIDE

View entire compound with spectra: 1 FTIR

3,3a,4,5,6,7-HEXAHYDRO-3-HYDROXYTHIO-3-(TRIFLUOROMETHYL)-2H-INDAZOLE-2-CARBOXAMIDE
SpectraBase Compound ID CCBnQKqgetg
InChI InChI=1S/C9H12F3N3OS/c10-9(11,12)8(16)5-3-1-2-4-6(5)14-15(8)7(13)17/h5,16H,1-4H2,(H2,13,17)
InChIKey CGTPEBJCRIOMLM-UHFFFAOYSA-N
Mol Weight 267.27 g/mol
Molecular Formula C9H12F3N3OS
Exact Mass 267.065318 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 86G4BN8bs1t
Name 3,3a,4,5,6,7-HEXAHYDRO-3-HYDROXYTHIO-3-(TRIFLUOROMETHYL)-2H-INDAZOLE-2-CARBOXAMIDE
Source of Sample H. Secor, Philip Morris Research Center, Richmond, Virginia
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12F3N3OS
InChI InChI=1S/C9H12F3N3OS/c10-9(11,12)8(16)5-3-1-2-4-6(5)14-15(8)7(13)17/h5,16H,1-4H2,(H2,13,17)
InChIKey CGTPEBJCRIOMLM-UHFFFAOYSA-N
Literature Reference JMCH 14, 997(1971)
Melting Point 95-96C
Molecular Weight 267.274994
Synonyms 2H-INDAZOLE-2-CARBOXAMIDE, 3,3A,4,5,6,7-HEXAHYDRO-3-HYDROXYTHIO- 3-/TRIFLUOROMETHYL/-,
Technique KBr WAFER