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Iso-Propyl 2-(hex-1-ynyl)phenylcarbamothioate
SpectraBase Compound ID 6STl2GbEiwr
InChI InChI=1S/C16H21NOS/c1-4-5-6-7-10-14-11-8-9-12-15(14)17-16(19)18-13(2)3/h8-9,11-13H,4-6H2,1-3H3,(H,17,19)
InChIKey UCZSILKWYJHUTH-UHFFFAOYSA-N
Mol Weight 275.41 g/mol
Molecular Formula C16H21NOS
Exact Mass 275.134385 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ODxze25hn1
Name Iso-Propyl 2-(hex-1-ynyl)phenylcarbamothioate
Alternate Name(s) O-isopropyl (2-(hex-1-yn-1-yl)phenyl)carbamothioate
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Formula C16H21NOS
InChI InChI=1S/C16H21NOS/c1-4-5-6-7-10-14-11-8-9-12-15(14)17-16(19)18-13(2)3/h8-9,11-13H,4-6H2,1-3H3,(H,17,19)
InChIKey UCZSILKWYJHUTH-UHFFFAOYSA-N
Molecular Weight 275.410 g/mol
SMILES N(C(=S)OC(C)C)c1c(C#CCCCC)cccc1
SPLASH splash10-001i-0920000000-ae82f30c4007578d620e
Source of Spectrum F-69-6486-9d
Wiley ID 1738377