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1-[3-((E)-4-Chloro-but-2-enyl)-6-hydroxy-2,4-dimethyl-phenyl]-ethanone
SpectraBase Compound ID 6atyGiJbWSo
InChI InChI=1S/C14H17ClO2/c1-9-8-13(17)14(11(3)16)10(2)12(9)6-4-5-7-15/h4-5,8,17H,6-7H2,1-3H3/b5-4+
InChIKey LTRBSNYUVTXNJZ-SNAWJCMRSA-N
Mol Weight 252.74 g/mol
Molecular Formula C14H17ClO2
Exact Mass 252.091707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JngtGaqDMkr
Name 1-[3-((E)-4-Chloro-but-2-enyl)-6-hydroxy-2,4-dimethyl-phenyl]-ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17ClO2
InChI InChI=1S/C14H17ClO2/c1-9-8-13(17)14(11(3)16)10(2)12(9)6-4-5-7-15/h4-5,8,17H,6-7H2,1-3H3/b5-4+
InChIKey LTRBSNYUVTXNJZ-SNAWJCMRSA-N
Molecular Weight 252.741 g/mol
SMILES Oc1c(c(c(C\C=C\CCl)c(c1)C)C)C(=O)C
SPLASH splash10-014i-0090000000-444b886d0d7102700402
Source of Spectrum U1-2010-3747-3e
Synonyms 5-[(E)-4-Chlorobut-2-enyl]-4,6-dimethylacetophenone 1-[3-[(E)-4-chlorobut-2-enyl]-6-hydroxy-2,4-dimethylphenyl]ethanone 1-[3-[(E)-4-chloranylbut-2-enyl]-2,4-dimethyl-6-oxidanyl-phenyl]ethanone
Wiley ID 1663978