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Bicyclo[2.2.2]octanone, 4,6,6-trimethyl-8-(1-oxo-2-propenyl)-, (1.alpha.,4.alpha.,8S*)-(.+-.)-
SpectraBase Compound ID H2XcidHMYWw
InChI InChI=1S/C14H20O2/c1-5-11(15)10-6-9-12(16)7-14(10,4)8-13(9,2)3/h5,9-10H,1,6-8H2,2-4H3/t9-,10?,14+/m0/s1
InChIKey NCKBDJDOEALERG-UGJFRGMJSA-N
Mol Weight 220.31 g/mol
Molecular Formula C14H20O2
Exact Mass 220.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AI7mLwQNfUP
Name Bicyclo[2.2.2]octanone, 4,6,6-trimethyl-8-(1-oxo-2-propenyl)-, (1.alpha.,4.alpha.,8S*)-(.+-.)-
Alternate Name(s) 4,6,6-Trimethyl-2-oxobicyclo[2.2.2]octan-8-yl vinyl ketone 5-Acryloyl-4,7,7-trimethylbicyclo[2.2.2]octan-2-one
CAS Registry Number 99794-42-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O2
InChI InChI=1S/C14H20O2/c1-5-11(15)10-6-9-12(16)7-14(10,4)8-13(9,2)3/h5,9-10H,1,6-8H2,2-4H3/t9-,10?,14+/m0/s1
InChIKey NCKBDJDOEALERG-UGJFRGMJSA-N
Molecular Weight 220.312 g/mol
SMILES [C@@]12(C(C[C@@](C(C2)=O)(C(C1)(C)C)[H])C(C=C)=O)C
SPLASH splash10-0abl-9600000000-aca549c6fcb1ba44bf38
Source of Spectrum KC-1990-2112-13
Wiley ID 1220249