CID 11369906

11z-eicosenal

Structural Information

Molecular Formula
C20H38O
SMILES
CCCCCCCC/C=C\CCCCCCCCCC=O
InChI
InChI=1S/C20H38O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21/h9-10,20H,2-8,11-19H2,1H3/b10-9-
InChIKey
WJLJKNYXWACGHC-KTKRTIGZSA-N
Compound name
(Z)-icos-11-enal
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
Patents

294.29227 Da
Monoisotopic Mass

8.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.29955 182.3
[M+Na]+ 317.28149 184.4
[M-H]- 293.28499 180.1
[M+NH4]+ 312.32609 198.0
[M+K]+ 333.25543 179.8
[M+H-H2O]+ 277.28953 175.4
[M+HCOO]- 339.29047 202.2
[M+CH3COO]- 353.30612 209.1
[M+Na-2H]- 315.26694 182.0
[M]+ 294.29172 189.0
[M]- 294.29282 189.0
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.