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1-Chloro-1-(phenylsulfinyl)undec-5-yn-2-one

View entire compound with spectra: 1 MS (GC)

1-Chloro-1-(phenylsulfinyl)undec-5-yn-2-one
SpectraBase Compound ID A3AWCaAVnFJ
InChI InChI=1S/C17H21ClO2S/c1-2-3-4-5-6-7-11-14-16(19)17(18)21(20)15-12-9-8-10-13-15/h8-10,12-13,17H,2-5,11,14H2,1H3
InChIKey YJQNSVYFGCTVQS-UHFFFAOYSA-N
Mol Weight 324.87 g/mol
Molecular Formula C17H21ClO2S
Exact Mass 324.095079 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ToYW334IPJ
Name 1-Chloro-1-(phenylsulfinyl)undec-5-yn-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21ClO2S
InChI InChI=1S/C17H21ClO2S/c1-2-3-4-5-6-7-11-14-16(19)17(18)21(20)15-12-9-8-10-13-15/h8-10,12-13,17H,2-5,11,14H2,1H3
InChIKey YJQNSVYFGCTVQS-UHFFFAOYSA-N
Molecular Weight 324.866 g/mol
SMILES C(C(CCC#CCCCCC)=O)(S(=O)c1ccccc1)Cl
SPLASH splash10-004i-0902000000-47c562d428b6f15a28c8
Source of Spectrum E2-51-604-4
Synonyms 1-(benzenesulfinyl)-1-chloro-5-undecyn-2-one 1-(benzenesulfinyl)-1-chloro-undec-5-yn-2-one 1-Chloranyl-1-(phenylsulfinyl)undec-5-yn-2-one
Wiley ID 1556085