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Cyclopentaneacetic acid, 2-(2-hydroxy-4-methoxybenzoyl)-2-methyl-, cis-(.+-.)-
SpectraBase Compound ID Fmd8sw4ZVq7
InChI InChI=1S/C16H20O5/c1-16(7-3-4-10(16)8-14(18)19)15(20)12-6-5-11(21-2)9-13(12)17/h5-6,9-10,17H,3-4,7-8H2,1-2H3,(H,18,19)/t10-,16+/m0/s1
InChIKey CECZLOXJDFGOLU-MGPLVRAMSA-N
Mol Weight 292.33 g/mol
Molecular Formula C16H20O5
Exact Mass 292.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D6ArMeofzBV
Name Cyclopentaneacetic acid, 2-(2-hydroxy-4-methoxybenzoyl)-2-methyl-, cis-(.+-.)-
Alternate Name(s) c-2-(2'-hydroxy-4'-methoxybenzoyl)-t-2-methylcyclopent-r-ylacetic acid [(1S,2R)-2-(2-hydroxy-4-methoxybenzoyl)-2-methylcyclopentyl]acetic acid
CAS Registry Number 70433-34-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O5
InChI InChI=1S/C16H20O5/c1-16(7-3-4-10(16)8-14(18)19)15(20)12-6-5-11(21-2)9-13(12)17/h5-6,9-10,17H,3-4,7-8H2,1-2H3,(H,18,19)/t10-,16+/m0/s1
InChIKey CECZLOXJDFGOLU-MGPLVRAMSA-N
Molecular Weight 292.331 g/mol
SMILES Oc1c(C([C@]2([C@](CC(=O)O)(CCC2)[H])C)=O)ccc(c1)OC
SPLASH splash10-0udi-3900000000-b28db283f1bfb4712208
Source of Spectrum B-32-375-0
Wiley ID 1295366