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1-[(Dimethyl)methylene]-3-[(T-butyl)ethynyl]-5,5-dimethylcyclohex-2-ene
SpectraBase Compound ID 8Eb7kkE5Wjm
InChI InChI=1S/C17H26/c1-13(2)15-10-14(8-9-16(3,4)5)11-17(6,7)12-15/h10H,11-12H2,1-7H3
InChIKey VACZMKBIIRDVBE-UHFFFAOYSA-N
Mol Weight 230.39 g/mol
Molecular Formula C17H26
Exact Mass 230.203451 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FEeTOJwoqmZ
Name 1-[(Dimethyl)methylene]-3-[(T-butyl)ethynyl]-5,5-dimethylcyclohex-2-ene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 230.203450837 u
Formula C17H26
InChI InChI=1S/C17H26/c1-13(2)15-10-14(8-9-16(3,4)5)11-17(6,7)12-15/h10H,11-12H2,1-7H3
InChIKey VACZMKBIIRDVBE-UHFFFAOYSA-N
Molecular Weight 230.395 g/mol
SMILES C1(C=C(C#CC(C)(C)C)CC(C1)(C)C)=C(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.928573