CID 5283352

2,4,7-decatrienal

Structural Information

Molecular Formula
C10H14O
SMILES
CC/C=C/C/C=C/C=C/C=O
InChI
InChI=1S/C10H14O/c1-2-3-4-5-6-7-8-9-10-11/h3-4,6-10H,2,5H2,1H3/b4-3+,7-6+,9-8+
InChIKey
KEXCNWISTVJVBV-SIRUGEDZSA-N
Compound name
(2E,4E,7E)-deca-2,4,7-trienal
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

11
References

166
Patents

150.10446 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.11174 134.0
[M+Na]+ 173.09368 141.1
[M-H]- 149.09718 133.9
[M+NH4]+ 168.13828 155.5
[M+K]+ 189.06762 138.0
[M+H-H2O]+ 133.10172 129.4
[M+HCOO]- 195.10266 157.7
[M+CH3COO]- 209.11831 175.7
[M+Na-2H]- 171.07913 139.3
[M]+ 150.10391 135.3
[M]- 150.10501 135.3
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