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(3S,6E)-6-Chloro-3-hydroxynona-1,6-dien-5-one
SpectraBase Compound ID 2MRnNTcpELG
InChI InChI=1S/C9H13ClO2/c1-3-5-8(10)9(12)6-7(11)4-2/h4-5,7,11H,2-3,6H2,1H3/b8-5+/t7-/m1/s1
InChIKey SYUQHZXNYXZOND-KBUNYLKBSA-N
Mol Weight 188.65 g/mol
Molecular Formula C9H13ClO2
Exact Mass 188.060407 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B00cN8TpEzA
Name (3S,6E)-6-Chloro-3-hydroxynona-1,6-dien-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13ClO2
InChI InChI=1S/C9H13ClO2/c1-3-5-8(10)9(12)6-7(11)4-2/h4-5,7,11H,2-3,6H2,1H3/b8-5+/t7-/m1/s1
InChIKey SYUQHZXNYXZOND-KBUNYLKBSA-N
Molecular Weight 188.654 g/mol
SMILES O[C@](C=C)(CC(\C(=C/CC)Cl)=O)[H]
SPLASH splash10-0abc-9000000000-7f7b1f3d246ca820b016
Source of Spectrum C5-2004-2455-6
Synonyms (3S,6E)-6-chloro-3-hydroxy-1,6-nonadien-5-one
Wiley ID 1617336