CID 5312592

2z,4e-nonadienoic acid

Structural Information

Molecular Formula
C9H14O2
SMILES
CCCC/C=C/C=C\C(=O)O
InChI
InChI=1S/C9H14O2/c1-2-3-4-5-6-7-8-9(10)11/h5-8H,2-4H2,1H3,(H,10,11)/b6-5+,8-7-
InChIKey
YAWXLPDXHPHGPX-MDAAKZFYSA-N
Compound name
(2Z,4E)-nona-2,4-dienoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

154.09938 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.10666 135.5
[M+Na]+ 177.08860 141.9
[M-H]- 153.09210 134.1
[M+NH4]+ 172.13320 156.0
[M+K]+ 193.06254 139.6
[M+H-H2O]+ 137.09664 131.0
[M+HCOO]- 199.09758 157.0
[M+CH3COO]- 213.11323 174.3
[M+Na-2H]- 175.07405 139.3
[M]+ 154.09883 136.0
[M]- 154.09993 136.0
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.