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Cyclopentaneacetic acid, 2-formyl-5-oxo-, methyl ester, trans-(.+-.)-
SpectraBase Compound ID UOPQjARiM1
InChI InChI=1S/C9H12O4/c1-13-9(12)4-7-6(5-10)2-3-8(7)11/h5-7H,2-4H2,1H3/t6-,7-/m0/s1
InChIKey MJFBPUIFPKWHIO-BQBZGAKWSA-N
Mol Weight 184.19 g/mol
Molecular Formula C9H12O4
Exact Mass 184.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JfNfOsC3ut3
Name Cyclopentaneacetic acid, 2-formyl-5-oxo-, methyl ester, trans-(.+-.)-
CAS Registry Number 117462-09-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O4
InChI InChI=1S/C9H12O4/c1-13-9(12)4-7-6(5-10)2-3-8(7)11/h5-7H,2-4H2,1H3/t6-,7-/m0/s1
InChIKey MJFBPUIFPKWHIO-BQBZGAKWSA-N
Molecular Weight 184.191 g/mol
SMILES [C@@]1(C(CC[C@]1(C=O)[H])=O)(CC(=O)OC)[H]
SPLASH splash10-001i-9500000000-6eb120e0c1f8a73425bc
Source of Spectrum F-44-1216-6
Synonyms 3-Formyl-2-methoxycarbonylmethylcyclopentane-1-one Methyl[(1S,2R)-2-formyl-5-oxocyclopentyl]acetate
Wiley ID 1180337