CID 56936075

11z-nonacosene

Structural Information

Molecular Formula
C29H58
SMILES
CCCCCCCCCCCCCCCCC/C=C\CCCCCCCCCC
InChI
InChI=1S/C29H58/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h21,23H,3-20,22,24-29H2,1-2H3/b23-21-
InChIKey
GZDZVTNYHONRIK-LNVKXUELSA-N
Compound name
(Z)-nonacos-11-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

406.45386 Da
Monoisotopic Mass

15.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 407.46114 220.0
[M+Na]+ 429.44308 218.0
[M-H]- 405.44658 215.9
[M+NH4]+ 424.48768 231.2
[M+K]+ 445.41702 211.1
[M+H-H2O]+ 389.45112 211.4
[M+HCOO]- 451.45206 236.3
[M+CH3COO]- 465.46771 234.7
[M+Na-2H]- 427.42853 214.8
[M]+ 406.45331 229.3
[M]- 406.45441 229.3
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.