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cis-6-(3-Chloropropyl)-5-methyl-4-(phenylthio)-1,2,5,6-tetrahydro-2-pyridinone

View entire compound with spectra: 1 MS (GC)

cis-6-(3-Chloropropyl)-5-methyl-4-(phenylthio)-1,2,5,6-tetrahydro-2-pyridinone
SpectraBase Compound ID CEthwMhmdab
InChI InChI=1S/C15H18ClNOS/c1-11-13(8-5-9-16)17-15(18)10-14(11)19-12-6-3-2-4-7-12/h2-4,6-7,10-11,13H,5,8-9H2,1H3,(H,17,18)/t11-,13+/m0/s1
InChIKey QIADATYAARXEBE-WCQYABFASA-N
Mol Weight 295.83 g/mol
Molecular Formula C15H18ClNOS
Exact Mass 295.079763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1mtCALpl5M
Name cis-6-(3-Chloropropyl)-5-methyl-4-(phenylthio)-1,2,5,6-tetrahydro-2-pyridinone
Alternate Name(s) (5S,6R)-6-(3-chloropropyl)-5-methyl-4-(phenylthio)-5,6-dihydropyridin-2(1H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18ClNOS
InChI InChI=1S/C15H18ClNOS/c1-11-13(8-5-9-16)17-15(18)10-14(11)19-12-6-3-2-4-7-12/h2-4,6-7,10-11,13H,5,8-9H2,1H3,(H,17,18)/t11-,13+/m0/s1
InChIKey QIADATYAARXEBE-WCQYABFASA-N
Molecular Weight 295.828 g/mol
SMILES N1C(C=C([C@]([C@]1(CCCCl)[H])(C)[H])Sc1ccccc1)=O
SPLASH splash10-001l-9540000000-6784e86bd01de9c268f0
Source of Spectrum F-70-7462-4
Wiley ID 1743175