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1-(5-Iodopentyl)-4-(phenylthio)-5,6-dihydropyridin-2(1H)-one

View entire compound with spectra: 1 MS (GC)

1-(5-Iodopentyl)-4-(phenylthio)-5,6-dihydropyridin-2(1H)-one
SpectraBase Compound ID KRAh76T8HcL
InChI InChI=1S/C16H20INOS/c17-10-5-2-6-11-18-12-9-15(13-16(18)19)20-14-7-3-1-4-8-14/h1,3-4,7-8,13H,2,5-6,9-12H2
InChIKey BHOREPMQODKCJU-UHFFFAOYSA-N
Mol Weight 401.31 g/mol
Molecular Formula C16H20INOS
Exact Mass 401.03103 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 99rRmvduF0y
Name 1-(5-Iodopentyl)-4-(phenylthio)-5,6-dihydropyridin-2(1H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20INOS
InChI InChI=1S/C16H20INOS/c17-10-5-2-6-11-18-12-9-15(13-16(18)19)20-14-7-3-1-4-8-14/h1,3-4,7-8,13H,2,5-6,9-12H2
InChIKey BHOREPMQODKCJU-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.201000113
Molecular Weight 401.306 g/mol
SMILES C1(C=C(CCN1CCCCCI)Sc1ccccc1)=O
SPLASH splash10-00y0-1290100000-12ddc27ea3dc6c0f22fd
Source of Spectrum QA-57-817-7b
Wiley ID 1791236