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3a,7-Methano-3aH-cyclopentacycloocten-3(2H)-one, octahydro-1,7-dimethyl-, (1.alpha.,3a.beta.,7.beta.,9a.alpha.)-(.+-.)-
SpectraBase Compound ID 5NqU7qekLuU
InChI InChI=1S/C14H22O/c1-10-8-12(15)14-6-3-5-13(2,9-14)7-4-11(10)14/h10-11H,3-9H2,1-2H3/t10-,11+,13-,14-/m0/s1
InChIKey JOOJPNROMKXJFL-XCCSTKFXSA-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 5mA59jx2XGU
Name 3a,7-Methano-3aH-cyclopentacycloocten-3(2H)-one, octahydro-1,7-dimethyl-, (1.alpha.,3a.beta.,7.beta.,9a.alpha.)-(.+-.)-
Alternate Name(s) (1RS,4SR,5RS,8SR)-4,8-dimethylbicyclo[6.3.1.0(1,5)]dodecan-2-one (1S,4S,5R,8S)-4,8-dimethyltricyclo[6.3.1.0(1,5)]dodecan-2-one
CAS Registry Number 94609-09-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O
InChI InChI=1S/C14H22O/c1-10-8-12(15)14-6-3-5-13(2,9-14)7-4-11(10)14/h10-11H,3-9H2,1-2H3/t10-,11+,13-,14-/m0/s1
InChIKey JOOJPNROMKXJFL-XCCSTKFXSA-N
Molecular Weight 206.329 g/mol
SMILES [C@@]123C(C[C@@]([C@]3(CC[C@](C1)(C)CCC2)[H])(C)[H])=O
SPLASH splash10-0a4i-9750000000-d48e94774f8e0cd577ea
Source of Spectrum H-67-1968-0
Wiley ID 1205109