CID 6437646

2,6,10,15,19,23-hexamethyltetracosene

Structural Information

Molecular Formula
C30H60
SMILES
CC(C)CCCC(C)CCCC(C)CCCCC(C)C/C=C/C(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/h13,23,25-30H,9-12,14-22,24H2,1-8H3/b23-13+
InChIKey
WTFIBNFIISRGHJ-YDZHTSKRSA-N
Compound name
(E)-2,6,10,15,19,23-hexamethyltetracos-7-ene
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

712
Patents

420.4695 Da
Monoisotopic Mass

13.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 421.476776 227.5
[M+Na]+ 443.458718 224.2
[M-H]- 419.462224 223.9
[M+NH4]+ 438.503323 229.9
[M+K]+ 459.432658 219.8
[M+H-H2O]+ 403.466760 219.9
[M+HCOO]- 465.467701 222.6
[M+CH3COO]- 479.483351 241.9
[M+Na-2H]- 441.444166 214.4
[M]+ 420.46895142 233.3
[M]- 420.47004858 233.3
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

patents stripe