CID 44256591

9z-nonadecenal

Structural Information

Molecular Formula
C19H36O
SMILES
CCCCCCCCC/C=C\CCCCCCCC=O
InChI
InChI=1S/C19H36O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20/h10-11,19H,2-9,12-18H2,1H3/b11-10-
InChIKey
AKQYTSLMKKEXOK-KHPPLWFESA-N
Compound name
(Z)-nonadec-9-enal
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

280.2766 Da
Monoisotopic Mass

7.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.28388 177.9
[M+Na]+ 303.26582 180.4
[M-H]- 279.26932 175.8
[M+NH4]+ 298.31042 194.2
[M+K]+ 319.23976 176.1
[M+H-H2O]+ 263.27386 171.2
[M+HCOO]- 325.27480 198.1
[M+CH3COO]- 339.29045 206.1
[M+Na-2H]- 301.25127 178.1
[M]+ 280.27605 184.2
[M]- 280.27715 184.2
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.