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Bicyclo[2.2.1]heptane, 3-(2-ethylidenepentyl)-2,2-dimethyl-, endo-
SpectraBase Compound ID 9GyeVzalMfj
InChI InChI=1S/C16H28/c1-5-7-12(6-2)10-15-13-8-9-14(11-13)16(15,3)4/h6,13-15H,5,7-11H2,1-4H3/b12-6+/t13-,14-,15+/m0/s1
InChIKey NPQDZRRWFAJPQM-GOHRIHQBSA-N
Mol Weight 220.4 g/mol
Molecular Formula C16H28
Exact Mass 220.219101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9iGx80xiWaj
Name Bicyclo[2.2.1]heptane, 3-(2-ethylidenepentyl)-2,2-dimethyl-, endo-
Alternate Name(s) 1-(3,3-Dimethyl-bicyclo[2.2.1.]hept-2-yl)-2-propyl-2-butene 2,2-Dimethyl-3-[(2E)-2-propyl-2-butenyl]bicyclo[2.2.1]heptane
CAS Registry Number 104122-65-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28
InChI InChI=1S/C16H28/c1-5-7-12(6-2)10-15-13-8-9-14(11-13)16(15,3)4/h6,13-15H,5,7-11H2,1-4H3/b12-6+/t13-,14-,15+/m0/s1
InChIKey NPQDZRRWFAJPQM-GOHRIHQBSA-N
Molecular Weight 220.400 g/mol
SMILES C1([C@@]([C@@]2(C[C@@]1(CC2)[H])[H])(C\C(=C\C)CCC)[H])(C)C
SPLASH splash10-060u-9400000000-712d40a394670664c13c
Source of Spectrum AH-116-812-43
Wiley ID 1220934