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5-Hydroxy-3-methylene-7-phenylheptan-2-one
SpectraBase Compound ID FBtK3QLuNVL
InChI InChI=1S/C14H18O2/c1-11(12(2)15)10-14(16)9-8-13-6-4-3-5-7-13/h3-7,14,16H,1,8-10H2,2H3
InChIKey LFDPCGCJGRIJMV-UHFFFAOYSA-N
Mol Weight 218.3 g/mol
Molecular Formula C14H18O2
Exact Mass 218.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KG8ugEmqFrN
Name 5-Hydroxy-3-methylene-7-phenylheptan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O2
InChI InChI=1S/C14H18O2/c1-11(12(2)15)10-14(16)9-8-13-6-4-3-5-7-13/h3-7,14,16H,1,8-10H2,2H3
InChIKey LFDPCGCJGRIJMV-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo501004j
Molecular Weight 218.296 g/mol
SMILES OC(CCc1ccccc1)CC(C(=O)C)=C
SPLASH splash10-00kf-9210000000-58a7b70c1a254461a90d
Source of Spectrum J-79-5984-3cn
Wiley ID 1746344