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Cyclohexaneacetic acid, 2-hydroxy-1-(3-methoxyphenyl)-, cis-
SpectraBase Compound ID ae3Iz1y9RT
InChI InChI=1S/C15H20O4/c1-19-12-6-4-5-11(9-12)15(10-14(17)18)8-3-2-7-13(15)16/h4-6,9,13,16H,2-3,7-8,10H2,1H3,(H,17,18)/t13-,15-/m0/s1
InChIKey MEPSYQYMEHIKFO-ZFWWWQNUSA-N
Mol Weight 264.32 g/mol
Molecular Formula C15H20O4
Exact Mass 264.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jluj8im0PTu
Name Cyclohexaneacetic acid, 2-hydroxy-1-(3-methoxyphenyl)-, cis-
CAS Registry Number 86446-18-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O4
InChI InChI=1S/C15H20O4/c1-19-12-6-4-5-11(9-12)15(10-14(17)18)8-3-2-7-13(15)16/h4-6,9,13,16H,2-3,7-8,10H2,1H3,(H,17,18)/t13-,15-/m0/s1
InChIKey MEPSYQYMEHIKFO-ZFWWWQNUSA-N
Molecular Weight 264.321 g/mol
SMILES OC(C[C@]1([C@](CCCC1)(O)[H])c1cc(OC)ccc1)=O
SPLASH splash10-0002-0950000000-c553cc55411664171bca
Source of Spectrum H-66-578-0
Synonyms [(1S,2S)-2-hydroxy-1-(3-methoxyphenyl)cyclohexyl]acetic acid [2.alpha.(a)-hydroxy-1-(m-methoxyphenyl)-1.beta.(a)-cyclohexyl]acetic acid
Wiley ID 1267941