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(S)-(-)-2-methyl-2-(4-methylphenyl)-4-but-3-enolide
SpectraBase Compound ID FX8FMuFaqYZ
InChI InChI=1S/C12H12O2/c1-9-3-5-10(6-4-9)12(2)7-8-14-11(12)13/h3-8H,1-2H3/t12-/m0/s1
InChIKey JYMVGSXFEOUYLI-LBPRGKRZSA-N
Mol Weight 188.23 g/mol
Molecular Formula C12H12O2
Exact Mass 188.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L3hq5G2dsYG
Name (S)-(-)-2-methyl-2-(4-methylphenyl)-4-but-3-enolide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O2
InChI InChI=1S/C12H12O2/c1-9-3-5-10(6-4-9)12(2)7-8-14-11(12)13/h3-8H,1-2H3/t12-/m0/s1
InChIKey JYMVGSXFEOUYLI-LBPRGKRZSA-N
Molecular Weight 188.226 g/mol
SMILES [C@]1(C(OC=C1)=O)(c1ccc(cc1)C)C
SPLASH splash10-00ks-2900000000-9bcf9ada10881e96184a
Source of Spectrum J-57-3472-32
Synonyms (3S)-3-methyl-3-(4-methylphenyl)-2(3H)-furanone (3S)-3-methyl-3-(4-methylphenyl)-2-furanone (3S)-3-methyl-3-(4-methylphenyl)furan-2-one
Wiley ID 1184972