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6-(3-Choloropropyl)-4-(phenylthio)-1,2,5,6-tetrahydro-2-pyridinone
SpectraBase Compound ID DcbyAQbZo7K
InChI InChI=1S/C14H16ClNOS/c15-8-4-5-11-9-13(10-14(17)16-11)18-12-6-2-1-3-7-12/h1-3,6-7,10-11H,4-5,8-9H2,(H,16,17)
InChIKey IYWVJXUDVDHTBR-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 4Wj4cFI2OFU
Name 6-(3-Choloropropyl)-4-(phenylthio)-1,2,5,6-tetrahydro-2-pyridinone
Alternate Name(s) 6-(3-Chloropropyl)-4-(phenylthio)-5,6-dihydropyridin-2(1H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16ClNOS
InChI InChI=1S/C14H16ClNOS/c15-8-4-5-11-9-13(10-14(17)16-11)18-12-6-2-1-3-7-12/h1-3,6-7,10-11H,4-5,8-9H2,(H,16,17)
InChIKey IYWVJXUDVDHTBR-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo102092b
Molecular Weight 281.801 g/mol
SMILES N1C(C=C(CC1CCCCl)Sc1ccccc1)=O
SPLASH splash10-0udi-1090000000-4ce3c75130bd2c718b32
Source of Spectrum J-76-692/SMS3-3a
Wiley ID 1751865