For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1,1'-((3R,4R)-3,4-Dimethylhexa-1,5-diene-2,5-diyl)dicyclohex-1-ene
SpectraBase Compound ID B8AULbDQSdL
InChI InChI=1S/C20H30/c1-15(17(3)19-11-7-5-8-12-19)16(2)18(4)20-13-9-6-10-14-20/h11,13,15-16H,3-10,12,14H2,1-2H3/t15-,16-/m1/s1
InChIKey VBVBTNGGUWQKON-HZPDHXFCSA-N
Mol Weight 270.46 g/mol
Molecular Formula C20H30
Exact Mass 270.234751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID A67aGkk1Akq
Name 1,1'-((3R,4R)-3,4-Dimethylhexa-1,5-diene-2,5-diyl)dicyclohex-1-ene
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30
InChI InChI=1S/C20H30/c1-15(17(3)19-11-7-5-8-12-19)16(2)18(4)20-13-9-6-10-14-20/h11,13,15-16H,3-10,12,14H2,1-2H3/t15-,16-/m1/s1
InChIKey VBVBTNGGUWQKON-HZPDHXFCSA-N
Instrument Name Thermo Finnigan TSQ 700
Ionization Type EI
Literature Reference DOI 10.1002/chem.201804497
Molecular Weight 270.460 g/mol
Optical Rotation [a]D25 = -122.8 (c = 0.68, CHCl3)
Quality 409
Reported Formula C20H30
SMILES C1(=CCCCC1)C([C@@]([C@](C(=C)C=1CCCCC1)(C)[H])(C)[H])=C
SPLASH splash10-0005-4930000000-f20aed9c879dc8d93386
Source of Spectrum QE-24-SM19-23 (DOI: 10.1002/chem.201804497)
Thin-Layer Chromatography 0.5 (n-pentane)
Wiley ID 1901793