CID 56936095

9z-hexacosene

Structural Information

Molecular Formula
C26H52
SMILES
CCCCCCCCCCCCCCCC/C=C\CCCCCCCC
InChI
InChI=1S/C26H52/c1-3-5-7-9-11-13-15-17-19-21-23-25-26-24-22-20-18-16-14-12-10-8-6-4-2/h17,19H,3-16,18,20-26H2,1-2H3/b19-17-
InChIKey
HGTCGIXAQAYYBS-ZPHPHTNESA-N
Compound name
(Z)-hexacos-9-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

364.4069 Da
Monoisotopic Mass

13.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.41418 207.1
[M+Na]+ 387.39612 206.4
[M-H]- 363.39962 203.6
[M+NH4]+ 382.44072 220.1
[M+K]+ 403.37006 200.4
[M+H-H2O]+ 347.40416 199.2
[M+HCOO]- 409.40510 224.5
[M+CH3COO]- 423.42075 226.0
[M+Na-2H]- 385.38157 203.6
[M]+ 364.40635 215.3
[M]- 364.40745 215.3
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

patents stripe