CID 20838917

Ixbqoeqetslhif-uhfffaoysa-n

Structural Information

Molecular Formula
C30H60
SMILES
CC(C)CCCC(C)CCCC(C)CCCCC(C)CCCC(C)CCCC(=C)C
InChI
InChI=1S/C30H60/c1-25(2)15-11-19-29(7)23-13-21-27(5)17-9-10-18-28(6)22-14-24-30(8)20-12-16-26(3)4/h26-30H,1,9-24H2,2-8H3
InChIKey
IXBQOEQETSLHIF-UHFFFAOYSA-N
Compound name
2,6,10,15,19,23-hexamethyltetracos-1-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

420.4695 Da
Monoisotopic Mass

14.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 421.476776 227.3
[M+Na]+ 443.458718 223.9
[M-H]- 419.462224 223.6
[M+NH4]+ 438.503323 229.3
[M+K]+ 459.432658 219.5
[M+H-H2O]+ 403.466760 219.6
[M+HCOO]- 465.467701 222.0
[M+CH3COO]- 479.483351 242.5
[M+Na-2H]- 441.444166 214.2
[M]+ 420.46895142 233.1
[M]- 420.47004858 233.1
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.