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1-{{5-{[(p-CHLOROPHENYL)THIO]METHYL}-2H-TETRAZOL-2-YL}ACETYL}-3-THIO-4-(alpha,alpha,alpha-TRIFLUORO-o-TOLYL)SEMICARBAZIDE
SpectraBase Compound ID 4npaTFSSMpf
InChI InChI=1S/C18H15ClF3N7OS2/c19-11-5-7-12(8-6-11)32-10-15-24-28-29(27-15)9-16(30)25-26-17(31)23-14-4-2-1-3-13(14)18(20,21)22/h1-8H,9-10H2,(H,25,30)(H2,23,26,31)
InChIKey NWFLHMJUXIPXSO-UHFFFAOYSA-N
Mol Weight 501.93 g/mol
Molecular Formula C18H15ClF3N7OS2
Exact Mass 501.042013 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID GeWuXa3K1FN
Name 1-{{5-{[(p-CHLOROPHENYL)THIO]METHYL}-2H-TETRAZOL-2-YL}ACETYL}-3-THIO-4-(alpha,alpha,alpha-TRIFLUORO-o-TOLYL)SEMICARBAZIDE
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15ClF3N7OS2
InChI InChI=1S/C18H15ClF3N7OS2/c19-11-5-7-12(8-6-11)32-10-15-24-28-29(27-15)9-16(30)25-26-17(31)23-14-4-2-1-3-13(14)18(20,21)22/h1-8H,9-10H2,(H,25,30)(H2,23,26,31)
InChIKey NWFLHMJUXIPXSO-UHFFFAOYSA-N
Melting Point 175-177C
Molecular Weight 501.936005
Synonyms SEMICARBAZIDE, 1-//5-///P-CHLORO- PHENYL/THIO/METHYL/-2H-TETRAZOL-2-YL/- ACETYL/-3-THIO-4-/A,A,A-TRIFLUORO- O-TOLYL/-,
Technique KBr WAFER