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(3aR,6S,6aS)-6-hydroxy-3,3a,4,5,6,6a-hexahydro-2H-pentalen-1-one
SpectraBase Compound ID EHQWt6JZQ0I
InChI InChI=1S/C8H12O2/c9-6-3-1-5-2-4-7(10)8(5)6/h5-6,8-9H,1-4H2/t5-,6+,8+/m1/s1
InChIKey HSMWANRQBQYTTN-CHKWXVPMSA-N
Mol Weight 140.18 g/mol
Molecular Formula C8H12O2
Exact Mass 140.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4k4fQqqjwfN
Name (3aR,6S,6aS)-6-hydroxy-3,3a,4,5,6,6a-hexahydro-2H-pentalen-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O2
InChI InChI=1S/C8H12O2/c9-6-3-1-5-2-4-7(10)8(5)6/h5-6,8-9H,1-4H2/t5-,6+,8+/m1/s1
InChIKey HSMWANRQBQYTTN-CHKWXVPMSA-N
Molecular Weight 140.182 g/mol
SMILES O[C@@]1([C@]2(C(CC[C@]2(CC1)[H])=O)[H])[H]
SPLASH splash10-01q9-9400000000-14c41de8aee336c75cc1
Source of Spectrum F-68-6458-5
Synonyms (3aR,6S,6aS)-6-oxidanyl-3,3a,4,5,6,6a-hexahydro-2H-pentalen-1-one
Wiley ID 1573183