CID 14275206

2,6,10,14-tetramethyl-7-(3-methyl-pentyl)-pentadecane

Structural Information

Molecular Formula
C25H52
SMILES
CCC(C)CCC(CCC(C)CCCC(C)C)C(C)CCCC(C)C
InChI
InChI=1S/C25H52/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/h20-25H,9-19H2,1-8H3
InChIKey
OFIAQLKCCAODLR-UHFFFAOYSA-N
Compound name
2,6,10,14-tetramethyl-7-(3-methylpentyl)pentadecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

352.4069 Da
Monoisotopic Mass

12.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.41418 206.7
[M+Na]+ 375.39612 205.0
[M-H]- 351.39962 204.0
[M+NH4]+ 370.44072 219.9
[M+K]+ 391.37006 202.5
[M+H-H2O]+ 335.40416 199.8
[M+HCOO]- 397.40510 218.3
[M+CH3COO]- 411.42075 229.0
[M+Na-2H]- 373.38157 196.2
[M]+ 352.40635 211.3
[M]- 352.40745 211.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.