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(3aR,3bR,6aS,7R,7aR)-3a,3b,7a-trimethyl-7-oxidanyl-2,3,4,6,6a,7-hexahydro-1H-cyclopenta[a]pentalen-5-one
SpectraBase Compound ID DdC1LOQSCXh
InChI InChI=1S/C14H22O2/c1-12-5-4-6-14(12,3)13(2)8-9(15)7-10(13)11(12)16/h10-11,16H,4-8H2,1-3H3/t10-,11-,12+,13-,14+/m1/s1
InChIKey BMDLJAUIXVPHGU-RGDJUOJXSA-N
Mol Weight 222.33 g/mol
Molecular Formula C14H22O2
Exact Mass 222.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HjiMbImUMiI
Name (3aR,3bR,6aS,7R,7aR)-3a,3b,7a-trimethyl-7-oxidanyl-2,3,4,6,6a,7-hexahydro-1H-cyclopenta[a]pentalen-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O2
InChI InChI=1S/C14H22O2/c1-12-5-4-6-14(12,3)13(2)8-9(15)7-10(13)11(12)16/h10-11,16H,4-8H2,1-3H3/t10-,11-,12+,13-,14+/m1/s1
InChIKey BMDLJAUIXVPHGU-RGDJUOJXSA-N
Molecular Weight 222.328 g/mol
SMILES O[C@@]1([C@@]2([C@]([C@@]3([C@]1(CCC3)C)C)(CC(=O)C2)C)[H])[H]
SPLASH splash10-004i-0920000000-487e111ca93d3da031cc
Source of Spectrum E1-41-34-21
Synonyms (3aR,3bR,6aS,7R,7aR)-7-hydroxy-3a,3b,7a-trimethyl-2,3,4,6,6a,7-hexahydro-1H-cyclopenta[a]pentalen-5-one
Wiley ID 1551841