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(4S)-4-Benzyloxymethyl-4-hydroxymethyl-4-methylcyclopent-2-en-1-one
SpectraBase Compound ID 84cH5l4POJE
InChI InChI=1S/C14H16O3/c15-10-14(7-6-13(16)8-14)11-17-9-12-4-2-1-3-5-12/h1-7,15H,8-11H2/t14-/m1/s1
InChIKey KRPARJCWJYHGTL-CQSZACIVSA-N
Mol Weight 232.28 g/mol
Molecular Formula C14H16O3
Exact Mass 232.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7QIQhLIctyL
Name (4S)-4-Benzyloxymethyl-4-hydroxymethyl-4-methylcyclopent-2-en-1-one
Alternate Name(s) (4S)-4-Benzyloxymethyl-4-hydroxymethyl-cyclopent-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O3
InChI InChI=1S/C14H16O3/c15-10-14(7-6-13(16)8-14)11-17-9-12-4-2-1-3-5-12/h1-7,15H,8-11H2/t14-/m1/s1
InChIKey KRPARJCWJYHGTL-CQSZACIVSA-N
Molecular Weight 232.279 g/mol
SMILES OC[C@]1(C=CC(C1)=O)COCc1ccccc1
SPLASH splash10-0006-9030000000-7d25c303ae4218afd6ee
Source of Spectrum KC-0-3585-33
Wiley ID 829658