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2-(trans-2,6,6-Trimethylbicyclo[3.3.1]heptan-3-yl)buta-1,3-diene
SpectraBase Compound ID K7DFLp77sKE
InChI InChI=1S/C14H22/c1-6-9(2)13-10(3)12-7-11(13)8-14(12,4)5/h6,10-13H,1-2,7-8H2,3-5H3/t10-,11+,12+,13+/m0/s1
InChIKey GQMSPIAKNMBAQP-UMSGYPCISA-N
Mol Weight 190.33 g/mol
Molecular Formula C14H22
Exact Mass 190.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JDxbV7bu3Kp
Name 2-(trans-2,6,6-Trimethylbicyclo[3.3.1]heptan-3-yl)buta-1,3-diene
Alternate Name(s) (5S,6S)-2,2,6-trimethyl-5-(1-methylene-2-propenyl)bicyclo[2.2.1]heptane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22
InChI InChI=1S/C14H22/c1-6-9(2)13-10(3)12-7-11(13)8-14(12,4)5/h6,10-13H,1-2,7-8H2,3-5H3/t10-,11+,12+,13+/m0/s1
InChIKey GQMSPIAKNMBAQP-UMSGYPCISA-N
Molecular Weight 190.330 g/mol
SMILES [C@]12([C@@]([C@@](C(C=C)=C)([C@](C2)(CC1(C)C)[H])[H])(C)[H])[H]
SPLASH splash10-0a5d-9400000000-78f4c9f43eac7b8e550a
Source of Spectrum KC-0-2698-5
Wiley ID 780112