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1,3,5-Triazine-2(1H)-thione, tetrahydro-5-(1-methylpropyl)-1-[3-(trifluoromethyl)phenyl]-
SpectraBase Compound ID 147MsQS3n7p
InChI InChI=1S/C14H18F3N3S/c1-3-10(2)19-8-18-13(21)20(9-19)12-6-4-5-11(7-12)14(15,16)17/h4-7,10H,3,8-9H2,1-2H3,(H,18,21)
InChIKey IEVNXCJTYBODQO-UHFFFAOYSA-N
Mol Weight 317.37 g/mol
Molecular Formula C14H18F3N3S
Exact Mass 317.117353 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5QLwqzvPpPT
Name 1,3,5-Triazine-2(1H)-thione, tetrahydro-5-(1-methylpropyl)-1-[3-(trifluoromethyl)phenyl]-
Alternate Name(s) 5-(butan-2-yl)-1-[3-(trifluoromethyl)phenyl]-1,3,5-triazinane-2-thione 5-Butan-2-yl-1-[3-(trifluoromethyl)phenyl]-1,3,5-triazinane-2-thione
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Formula C14H18F3N3S
InChI InChI=1S/C14H18F3N3S/c1-3-10(2)19-8-18-13(21)20(9-19)12-6-4-5-11(7-12)14(15,16)17/h4-7,10H,3,8-9H2,1-2H3,(H,18,21)
InChIKey IEVNXCJTYBODQO-UHFFFAOYSA-N
Molecular Weight 317.374 g/mol
SMILES N1CN(CN(C1=S)c1cccc(c1)C(F)(F)F)C(C)CC
SPLASH splash10-052u-9211000000-eb1773c0ec01daea798f
Source of Spectrum IY-2-4799-8
Wiley ID 1655981