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1-( 3'-Methyl-1',2'-pentadienyl)tricyclo[4.1.0(2,7)] heptane
SpectraBase Compound ID Jq0jPD6M4PB
InChI InChI=1S/C13H18/c1-3-9(2)7-8-13-10-5-4-6-11(13)12(10)13/h8,10-12H,3-6H2,1-2H3/t7?,10-,11+,12-,13+
InChIKey XVPVYNAXVUTJSN-NQRMNMRESA-N
Mol Weight 174.29 g/mol
Molecular Formula C13H18
Exact Mass 174.140851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GsDkgReZf2b
Name 1-( 3'-Methyl-1',2'-pentadienyl)tricyclo[4.1.0(2,7)] heptane
Alternate Name(s) 1-(3-Methyl-1,2-pentadienyl)tricyclo[4.1.0.0(2,7)]heptane
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Formula C13H18
InChI InChI=1S/C13H18/c1-3-9(2)7-8-13-10-5-4-6-11(13)12(10)13/h8,10-12H,3-6H2,1-2H3/t7?,10-,11+,12-,13+
InChIKey XVPVYNAXVUTJSN-NQRMNMRESA-N
Molecular Weight 174.287 g/mol
SMILES [C@]12([C@@]3([C@@]2(CCC[C@@]13[H])[H])[H])C=C=C(CC)C
SPLASH splash10-0aov-1900000000-1cba46e1f8f4f6316763
Source of Spectrum K-127-1081-6
Wiley ID 1171212