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2,2,4Alpha-trimethyl-3-methylenebicyclo[3.2.1]oct-6-ene

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

2,2,4Alpha-trimethyl-3-methylenebicyclo[3.2.1]oct-6-ene
SpectraBase Compound ID Kd3WThdo9k1
InChI InChI=1S/C12H18/c1-8-9(2)12(3,4)11-6-5-10(8)7-11/h5-6,8,10-11H,2,7H2,1,3-4H3
InChIKey QXFLTJHSDFGWNS-UHFFFAOYSA-N
Mol Weight 162.28 g/mol
Molecular Formula C12H18
Exact Mass 162.140851 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3mpVVL4G9ny
Name 2,2,4Alpha-trimethyl-3-methylenebicyclo[3.2.1]oct-6-ene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 162.140850580 u
Formula C12H18
InChI InChI=1S/C12H18/c1-8-9(2)12(3,4)11-6-5-10(8)7-11/h5-6,8,10-11H,2,7H2,1,3-4H3
InChIKey QXFLTJHSDFGWNS-UHFFFAOYSA-N
Molecular Weight 162.276 g/mol
SMILES C12CC(C(C(C2C)=C)(C)C)C=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.886869