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(4S,5S)-4-Butoxy-2-hydroxy-5-methyl-3-phenyl-4-vinylcyclopent-2-en-1-one
SpectraBase Compound ID 1t9Prv8CQi7
InChI InChI=1S/C18H22O3/c1-4-6-12-21-18(5-2)13(3)16(19)17(20)15(18)14-10-8-7-9-11-14/h5,7-11,13,20H,2,4,6,12H2,1,3H3/t13-,18+/m1/s1
InChIKey FIOLYRVCERXAEG-ACJLOTCBSA-N
Mol Weight 286.37 g/mol
Molecular Formula C18H22O3
Exact Mass 286.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Damig1wtftT
Name (4S,5S)-4-Butoxy-2-hydroxy-5-methyl-3-phenyl-4-vinylcyclopent-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O3
InChI InChI=1S/C18H22O3/c1-4-6-12-21-18(5-2)13(3)16(19)17(20)15(18)14-10-8-7-9-11-14/h5,7-11,13,20H,2,4,6,12H2,1,3H3/t13-,18+/m1/s1
InChIKey FIOLYRVCERXAEG-ACJLOTCBSA-N
Literature Reference DOI 10.1021/jo300806y
Molecular Weight 286.371 g/mol
SMILES OC=1C(=O)[C@@]([C@@](OCCCC)(C=C)C1c1ccccc1)([H])C
SPLASH splash10-0zfr-0290000000-a6088f9c2c9350a33e7a
Source of Spectrum J-77-6330-13a
Synonyms (4S,5S)-4-butoxy-2-hydroxy-5-methyl-3-phenyl-4-vinylcyclopent-2-enone (4S,5S)-4-butoxy-4-ethenyl-2-hydroxy-5-methyl-3-phenyl-1-cyclopent-2-enone (4S,5S)-4-butoxy-4-ethenyl-2-hydroxy-5-methyl-3-phenylcyclopent-2-en-1-one (4S,5S)-4-butoxy-4-ethenyl-5-methyl-2-oxidanyl-3-phenyl-cyclopent-2-en-1-one
Wiley ID 1745136