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(3aSR,7SR)-3a,7,7-Trimethyl-3a,4,5,6,7,7a-hexahydroinden-1-one
SpectraBase Compound ID mBvb8gYPhM
InChI InChI=1S/C12H18O/c1-11(2)6-4-7-12(3)8-5-9(13)10(11)12/h5,8,10H,4,6-7H2,1-3H3/t10-,12-/m0/s1
InChIKey SCQOJMWGEDBFTN-JQWIXIFHSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KrkOGf9YGOK
Name (3aSR,7SR)-3a,7,7-Trimethyl-3a,4,5,6,7,7a-hexahydroinden-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-11(2)6-4-7-12(3)8-5-9(13)10(11)12/h5,8,10H,4,6-7H2,1-3H3/t10-,12-/m0/s1
InChIKey SCQOJMWGEDBFTN-JQWIXIFHSA-N
Molecular Weight 178.275 g/mol
SMILES [C@@]12([C@@](C(=O)C=C2)(C(C)(C)CCC1)[H])C
SPLASH splash10-0a6s-9400000000-347a13ff7abdcccf56c6
Source of Spectrum F-68-3588-3
Wiley ID 1572397