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2-(1-Hydroxyethyl)-3-phenylheptanoic acid
SpectraBase Compound ID AkKl0FjqvLk
InChI InChI=1S/C15H22O3/c1-3-4-10-13(12-8-6-5-7-9-12)14(11(2)16)15(17)18/h5-9,11,13-14,16H,3-4,10H2,1-2H3,(H,17,18)
InChIKey XZAPZQQCWNOOJJ-UHFFFAOYSA-N
Mol Weight 250.34 g/mol
Molecular Formula C15H22O3
Exact Mass 250.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GC0PiWhMKdf
Name
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-3-4-10-13(12-8-6-5-7-9-12)14(11(2)16)15(17)18/h5-9,11,13-14,16H,3-4,10H2,1-2H3,(H,17,18)
InChIKey XZAPZQQCWNOOJJ-UHFFFAOYSA-N
Molecular Weight 250.1563
SMILES OC(C(C(O)C)C(CCCC)c1ccccc1)=O
SPLASH splash10-0007-6900000000-24c9a971d0663c57e358
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany