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cis-transoid-cis-1,12-Didehydrotricyclo[6.4.0.0(2,6)]dodecan-11-ones
SpectraBase Compound ID KJe8iRDb77c
InChI InChI=1S/C12H16O/c13-10-5-4-9-6-8-2-1-3-11(8)12(9)7-10/h7-9,11H,1-6H2
InChIKey NXSRGCYXNKAPBB-UHFFFAOYSA-N
Mol Weight 176.26 g/mol
Molecular Formula C12H16O
Exact Mass 176.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Aud2Bn9S2xF
Name cis-transoid-cis-1,12-Didehydrotricyclo[6.4.0.0(2,6)]dodecan-11-ones
Alternate Name(s) cis-cisoid-cis-1,12-Didehydrotricyclo-[6.4.0.0(2,6)]dodecan-11-ones 2,3,3a,6,7,7a,8,8a-octahydrocyclopenta[a]inden-5(1H)-one
CAS Registry Number 132883-22-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O
InChI InChI=1S/C12H16O/c13-10-5-4-9-6-8-2-1-3-11(8)12(9)7-10/h7-9,11H,1-6H2
InChIKey NXSRGCYXNKAPBB-UHFFFAOYSA-N
Molecular Weight 176.259 g/mol
SMILES C1=2C3C(CCC3)CC1CCC(C2)=O
SPLASH splash10-002b-0900000000-c89b6c40206d85124c87
Source of Spectrum AJ-63-3040-9
Wiley ID 1172785