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(1R,1E)-1-(2-Chlorophenyl)-1-hydroxyhept-4-en-3-one
SpectraBase Compound ID LEhsq4X0xrv
InChI InChI=1S/C13H15ClO2/c1-2-3-6-10(15)9-13(16)11-7-4-5-8-12(11)14/h3-8,13,16H,2,9H2,1H3/b6-3+/t13-/m1/s1
InChIKey IJEFILMEEYEDES-VUUYWXRKSA-N
Mol Weight 238.71 g/mol
Molecular Formula C13H15ClO2
Exact Mass 238.076057 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2qZDxlHmPCB
Name (1R,1E)-1-(2-Chlorophenyl)-1-hydroxyhept-4-en-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15ClO2
InChI InChI=1S/C13H15ClO2/c1-2-3-6-10(15)9-13(16)11-7-4-5-8-12(11)14/h3-8,13,16H,2,9H2,1H3/b6-3+/t13-/m1/s1
InChIKey IJEFILMEEYEDES-VUUYWXRKSA-N
Molecular Weight 238.714 g/mol
SMILES O[C@@](c1c(Cl)cccc1)(CC(\C=C\CC)=O)[H]
SPLASH splash10-053l-9600000000-5efe2bb6ff9f361a5d01
Source of Spectrum C5-2004-2456-8
Synonyms (1R,4E)-1-(2-chlorophenyl)-1-hydroxy-4-hepten-3-one
Wiley ID 1617328