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1-Tert-butyl-4-(neopentylidene)cyclohexane

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

1-Tert-butyl-4-(neopentylidene)cyclohexane
SpectraBase Compound ID 3FkxSsd9lF3
InChI InChI=1S/C15H28/c1-14(2,3)11-12-7-9-13(10-8-12)15(4,5)6/h11,13H,7-10H2,1-6H3/b12-11-
InChIKey OPOUNKUQTOITGR-QXMHVHEDSA-N
Mol Weight 208.39 g/mol
Molecular Formula C15H28
Exact Mass 208.219101 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3euqCDWH1I0
Name 1-Tert-butyl-4-(neopentylidene)cyclohexane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 208.219100902 u
Formula C15H28
InChI InChI=1S/C15H28/c1-14(2,3)11-12-7-9-13(10-8-12)15(4,5)6/h11,13H,7-10H2,1-6H3/b12-11-
InChIKey OPOUNKUQTOITGR-QXMHVHEDSA-N
Molecular Weight 208.389 g/mol
SMILES C(=C1CCC(C(C)(C)C)CC1)C(C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.976988