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Bicyclo[2.2.1]heptane, 2,2-dimethyl-3-(3-methyl-1,3-butadienyl)-, exo-
SpectraBase Compound ID IMtNTDSIDpq
InChI InChI=1S/C14H22/c1-10(2)5-8-13-11-6-7-12(9-11)14(13,3)4/h5,8,11-13H,1,6-7,9H2,2-4H3/b8-5+/t11-,12-,13+/m0/s1
InChIKey FZHNPVQRRSMRDG-VMPITWQZSA-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 IxddTzGfdSY
Name Bicyclo[2.2.1]heptane, 2,2-dimethyl-3-(3-methyl-1,3-butadienyl)-, exo-
CAS Registry Number 113104-77-1
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22
InChI InChI=1S/C14H22/c1-10(2)5-8-13-11-6-7-12(9-11)14(13,3)4/h5,8,11-13H,1,6-7,9H2,2-4H3/b8-5+/t11-,12-,13+/m0/s1
InChIKey FZHNPVQRRSMRDG-VMPITWQZSA-N
Molecular Weight 190.330 g/mol
SMILES C1([C@](\C=C\C(=C)C)([C@@]2(C[C@@]1(CC2)[H])[H])[H])(C)C
SPLASH splash10-05mo-9300000000-bb093dca4c59009111d4
Source of Spectrum AH-118-397-27
Synonyms 1-(3,3-Dimethyl-2-exo-norbornyl)-3-methylbuta-1,3-dien 2,2-Dimethyl-3-[(1E)-3-methyl-1,3-butadienyl]bicyclo[2.2.1]heptane
Wiley ID 1187220