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(3a.beta.,4.alpha.,6a.alpha.,9a.beta.,10a.alpha.)-Dodecahydro-4,9.alpha.-dimethyldicyclopenta[a,d]cycloocten-1(2H)-one
SpectraBase Compound ID 7ZmMLDn05T1
InChI InChI=1S/C16H26O/c1-10-3-5-12-6-4-11(2)14(12)9-15-13(10)7-8-16(15)17/h10-15H,3-9H2,1-2H3/t10-,11+,12+,13-,14+,15-/m1/s1
InChIKey CSYPHPDDRMIROO-ULXLPNHUSA-N
Mol Weight 234.38 g/mol
Molecular Formula C16H26O
Exact Mass 234.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Et14gG9gvxe
Name (3a.beta.,4.alpha.,6a.alpha.,9a.beta.,10a.alpha.)-Dodecahydro-4,9.alpha.-dimethyldicyclopenta[a,d]cycloocten-1(2H)-one
CAS Registry Number 97719-03-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O
InChI InChI=1S/C16H26O/c1-10-3-5-12-6-4-11(2)14(12)9-15-13(10)7-8-16(15)17/h10-15H,3-9H2,1-2H3/t10-,11+,12+,13-,14+,15-/m1/s1
InChIKey CSYPHPDDRMIROO-ULXLPNHUSA-N
Molecular Weight 234.383 g/mol
SMILES [C@]12(C[C@@]3([C@@](CC[C@@]3(C)[H])([H])CC[C@]([C@]1(CCC2=O)[H])(C)[H])[H])[H]
SPLASH splash10-05o3-9220000000-2fd87e6b97ddfb4ff965
Source of Spectrum J-50-3556-37
Synonyms (3aR,4R,6aR,9S,9aS,10aR)-4,9-dimethyldodecahydrodicyclopenta[a,d]cycloocten-1(2H)-one
Wiley ID 1236659