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3,5-Methano-2H-cyclopenta[b]furan-2-one, 3,3a,4,5,6,6a-hexahydro-7-syn-(hydroxymethyl)-, (3R,3a-trans,5-cis,6a-trans)-
SpectraBase Compound ID Cpodh9NRra6
InChI InChI=1S/C9H12O3/c10-3-6-4-1-5-7(2-4)12-9(11)8(5)6/h4-8,10H,1-3H2
InChIKey PLQZGYNJIGZRKY-UHFFFAOYSA-N
Mol Weight 168.19 g/mol
Molecular Formula C9H12O3
Exact Mass 168.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jee1rvVOsBo
Name 3,5-Methano-2H-cyclopenta[b]furan-2-one, 3,3a,4,5,6,6a-hexahydro-7-syn-(hydroxymethyl)-, (3R,3a-trans,5-cis,6a-trans)-
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c10-3-6-4-1-5-7(2-4)12-9(11)8(5)6/h4-8,10H,1-3H2
InChIKey PLQZGYNJIGZRKY-UHFFFAOYSA-N
Molecular Weight 168.192 g/mol
SMILES OCC1C2CC3OC(C1C3C2)=O
SPLASH splash10-004i-9000000000-2f021001484a6bb1e29a
Source of Spectrum H1-68-773-8
Wiley ID 1593516