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2-[(3aR,4S,6aS)-2-keto-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-4-yl]acetic acid
SpectraBase Compound ID 9uhnavdNeUa
InChI InChI=1S/C9H12O4/c10-8(11)3-5-1-2-7-6(5)4-9(12)13-7/h5-7H,1-4H2,(H,10,11)/t5-,6+,7-/m0/s1
InChIKey AHMZWWRKJYUGNR-XVMARJQXSA-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 6Mf9nzl8xcn
Name 2-[(3aR,4S,6aS)-2-keto-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-4-yl]acetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O4
InChI InChI=1S/C9H12O4/c10-8(11)3-5-1-2-7-6(5)4-9(12)13-7/h5-7H,1-4H2,(H,10,11)/t5-,6+,7-/m0/s1
InChIKey AHMZWWRKJYUGNR-XVMARJQXSA-N
Molecular Weight 184.191 g/mol
SMILES OC(C[C@]1([C@@]2([C@@](OC(C2)=O)(CC1)[H])[H])[H])=O
SPLASH splash10-000t-9500000000-4d4e354189b45fa7876d
Source of Spectrum J-60-5323-28
Synonyms 2-[(3aR,4S,6aS)-2-oxidanylidene-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-4-yl]ethanoic acid 2-[(3aR,4S,6aS)-2-oxo-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-4-yl]acetic acid
Wiley ID 1180367