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METHYL-3-HYDROXY-3-PHENYL-4-PENTANOATE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

METHYL-3-HYDROXY-3-PHENYL-4-PENTANOATE
SpectraBase Compound ID BXhpEIdlCLL
InChI InChI=1S/C12H16O3/c1-3-12(14,9-11(13)15-2)10-7-5-4-6-8-10/h4-8,14H,3,9H2,1-2H3
InChIKey BSHBGBOFTYYCBX-UHFFFAOYSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IZOV2KPpWzd
Name Methyl 3-hydroxy-3-phenylpentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-3-12(14,9-11(13)15-2)10-7-5-4-6-8-10/h4-8,14H,3,9H2,1-2H3
InChIKey BSHBGBOFTYYCBX-UHFFFAOYSA-N
Molecular Weight 208.257 g/mol
SMILES OC(c1ccccc1)(CC(=O)OC)CC
SPLASH splash10-0a6r-3900000000-8a207282f3ccef7b42af
Source of Spectrum NP-4-5764-0
Synonyms Methyl 3-hydroxy-3-phenylvalerate 3-Hydroxy-3-phenylpentanoic acid methyl ester Methyl 3-hydroxy-3-phenyl-pentanoate Methyl 3-oxidanyl-3-phenyl-pentanoate
Wiley ID 1104058