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1-(6-chloranyl-2-sulfanylidene-3,4-dihydroquinolin-1-yl)pentan-3-one
SpectraBase Compound ID ELix8W4A9z2
InChI InChI=1S/C14H16ClNOS/c1-2-12(17)7-8-16-13-5-4-11(15)9-10(13)3-6-14(16)18/h4-5,9H,2-3,6-8H2,1H3
InChIKey ACPVDLKJHDQBBC-UHFFFAOYSA-N
Mol Weight 281.8 g/mol
Molecular Formula C14H16ClNOS
Exact Mass 281.064113 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BqlmZ5Y03Fi
Name 1-(6-chloranyl-2-sulfanylidene-3,4-dihydroquinolin-1-yl)pentan-3-one
Alternate Name(s) 1-(6-chloro-2-sulfanylidene-3,4-dihydroquinolin-1-yl)-3-pentanone 1-(6-chloro-2-sulfanylidene-3,4-dihydroquinolin-1-yl)pentan-3-one 1-(6-chloro-2-thioxo-3,4-dihydroquinolin-1-yl)pentan-3-one
Comments Less than 3 mono-isotopic peaks
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Formula C14H16ClNOS
InChI InChI=1S/C14H16ClNOS/c1-2-12(17)7-8-16-13-5-4-11(15)9-10(13)3-6-14(16)18/h4-5,9H,2-3,6-8H2,1H3
InChIKey ACPVDLKJHDQBBC-UHFFFAOYSA-N
Molecular Weight 281.801 g/mol
SMILES c12N(C(CCc2cc(cc1)Cl)=S)CCC(=O)CC
SPLASH splash10-0a4i-9020000000-04a2e43b8460f78c2dd4
Source of Spectrum J-65-8094-4
Wiley ID 1533846