CID 6430525

2,6,10,14-tetramethyl-9-(3-methyl-pent-4-enylidene)-pentadeca-2,6(cis)-diene

Structural Information

Molecular Formula
C25H44
SMILES
CC(C)CCCC(C)/C(=C/CC(C)C=C)/C/C=C(/C)\CCC=C(C)C
InChI
InChI=1S/C25H44/c1-9-22(6)16-18-25(24(8)15-11-13-21(4)5)19-17-23(7)14-10-12-20(2)3/h9,12,17-18,21-22,24H,1,10-11,13-16,19H2,2-8H3/b23-17-,25-18+
InChIKey
NGTHMXZCVWHQKA-BRYXKCCLSA-N
Compound name
(6Z,9E)-2,6,10,14-tetramethyl-9-(3-methylpent-4-enylidene)pentadeca-2,6-diene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

344.3443 Da
Monoisotopic Mass

10.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.35158 198.9
[M+Na]+ 367.33352 198.7
[M-H]- 343.33702 196.5
[M+NH4]+ 362.37812 212.3
[M+K]+ 383.30746 193.8
[M+H-H2O]+ 327.34156 192.5
[M+HCOO]- 389.34250 211.4
[M+CH3COO]- 403.35815 223.6
[M+Na-2H]- 365.31897 188.8
[M]+ 344.34375 200.6
[M]- 344.34485 200.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.