SpectraBase Spectrum ID |
1Bp4NdFol1A |
Name |
C33-2 Tetramethylsqualene |
Appearance |
Colorless liquid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C33H56 |
InChI |
InChI=1S/C33H56/c1-25(2)30(8)21-19-29(7)18-14-17-27(5)15-12-13-16-28(6)20-22-32(10)33(11)24-23-31(9)26(3)4/h15-16,18,31-32H,3,11-14,17,19-24H2,1-2,4-10H3/b27-15+,28-16+,29-18+ |
InChIKey |
GKWFSSXRGLFOGW-YTMVTMPHSA-N |
Instrument Name |
Bruker 436-GC-SCION SQ |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/acs.jnatprod.6b00934 |
Molecular Weight |
452.811 g/mol |
Reported Formula |
C33H56 |
SMILES |
CC(=C)C(CCC(C(CC\C(=C\CC\C=C\(CC\C=C\(CCC(=C(C)C)C)C)C)C)C)=C)C |
SPLASH |
splash10-0fsj-9400000000-26c88f7ba06d2b295e84 |
Source of Spectrum |
G4-80-SM11-8 |
Wiley ID |
1867603 |