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N-(4-Bromo-3-methylphenyl)-1-piperidinecarbothioamide

View entire compound with spectra: 1 MS (GC)

N-(4-Bromo-3-methylphenyl)-1-piperidinecarbothioamide
SpectraBase Compound ID 8dQbUJVwmgA
InChI InChI=1S/C13H17BrN2S/c1-10-9-11(5-6-12(10)14)15-13(17)16-7-3-2-4-8-16/h5-6,9H,2-4,7-8H2,1H3,(H,15,17)
InChIKey AXLMMGNNMXJJNM-UHFFFAOYSA-N
Mol Weight 313.26 g/mol
Molecular Formula C13H17BrN2S
Exact Mass 312.029583 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JvCry58aYPf
Name N-(4-Bromo-3-methylphenyl)-1-piperidinecarbothioamide
Alternate Name(s) N-(4-bromanyl-3-methyl-phenyl)piperidine-1-carbothioamide N-(4-bromo-3-methyl-phenyl)piperidine-1-carbothioamide N1-(4-Bromo-3-methylphenyl)piperidine-1-carbothioamide
CAS Registry Number 282542-30-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17BrN2S
InChI InChI=1S/C13H17BrN2S/c1-10-9-11(5-6-12(10)14)15-13(17)16-7-3-2-4-8-16/h5-6,9H,2-4,7-8H2,1H3,(H,15,17)
InChIKey AXLMMGNNMXJJNM-UHFFFAOYSA-N
Molecular Weight 313.257 g/mol
SMILES N(C(N1CCCCC1)=S)c1cc(C)c(cc1)Br
SPLASH splash10-01t9-9631000000-af461542cee51dd19537
Source of Spectrum AD-0-2532-0
Wiley ID 1433234