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2,7-Dimethyl-4,5-bis(2-methylprop-1-en-1-yl)octa-2,4,6-triene

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

2,7-Dimethyl-4,5-bis(2-methylprop-1-en-1-yl)octa-2,4,6-triene
SpectraBase Compound ID 9og7I2vYeVA
InChI InChI=1S/C18H28/c1-13(2)9-17(10-14(3)4)18(11-15(5)6)12-16(7)8/h9-12H,1-8H3
InChIKey MQVAFBNKVGUTOK-UHFFFAOYSA-N
Mol Weight 244.42 g/mol
Molecular Formula C18H28
Exact Mass 244.219101 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8tjD5vV2okM
Name 2,7-Dimethyl-4,5-bis(2-methylprop-1-en-1-yl)octa-2,4,6-triene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 244.219100902 u
Formula C18H28
InChI InChI=1S/C18H28/c1-13(2)9-17(10-14(3)4)18(11-15(5)6)12-16(7)8/h9-12H,1-8H3
InChIKey MQVAFBNKVGUTOK-UHFFFAOYSA-N
Molecular Weight 244.422 g/mol
SMILES C(C)(=CC(C=C(C)C)=C(C=C(C)C)C=C(C)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.976675