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(3aS,3bS,6aR,7aS)-3a,5,5-trimethyl-1,2,3b,4,6,6a,7,7a-octahydrocyclopenta[a]pentalen-3-one
SpectraBase Compound ID KVJIMz4IFjn
InChI InChI=1S/C14H22O/c1-13(2)7-9-6-10-4-5-12(15)14(10,3)11(9)8-13/h9-11H,4-8H2,1-3H3/t9-,10+,11+,14+/m1/s1
InChIKey MSHAFSVXSCCYGE-ZHPDPMBESA-N
Mol Weight 206.33 g/mol
Molecular Formula C14H22O
Exact Mass 206.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EMFos0kZjHJ
Name (3aS,3bS,6aR,7aS)-3a,5,5-trimethyl-1,2,3b,4,6,6a,7,7a-octahydrocyclopenta[a]pentalen-3-one
CAS Registry Number 75331-64-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O
InChI InChI=1S/C14H22O/c1-13(2)7-9-6-10-4-5-12(15)14(10,3)11(9)8-13/h9-11H,4-8H2,1-3H3/t9-,10+,11+,14+/m1/s1
InChIKey MSHAFSVXSCCYGE-ZHPDPMBESA-N
Molecular Weight 206.329 g/mol
SMILES [C@]12([C@@]3([C@](CC(C3)(C)C)([H])C[C@@]1(CCC2=O)[H])[H])C
SPLASH splash10-08fs-9620000000-33915b43ca4aa98bab52
Source of Spectrum J-45-5026-0
Synonyms 3H-Cyclopenta[a]pentalen-3-one, decahydro-3a,5,5-trimethyl-, (3a.alpha.,3b.beta.,6a.beta.,7a.alpha.)-(.+-.)- (3a.alpha.,3b.beta.,6a.beta.,7a.alpha.)-(+-)-Decahydro-3a,5,5-trimethyl-3H-cyclopenta[a]pentalen-3-one 2,10,10-trimethyl-tricyclo[6.3.0(1,8).0(2,6)]undecanone-3
Wiley ID 1205126