CID 73242168

10-phospho-2e-decenoic acid

Structural Information

Molecular Formula
C10H19O6P
SMILES
C(CCC/C=C/C(=O)O)CCCOP(=O)(O)O
InChI
InChI=1S/C10H19O6P/c11-10(12)8-6-4-2-1-3-5-7-9-16-17(13,14)15/h6,8H,1-5,7,9H2,(H,11,12)(H2,13,14,15)/b8-6+
InChIKey
NAUNHDNEXRZFSD-SOFGYWHQSA-N
Compound name
(E)-10-phosphonooxydec-2-enoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

266.09192 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.09920 163.7
[M+Na]+ 289.08114 168.2
[M-H]- 265.08464 157.9
[M+NH4]+ 284.12574 178.5
[M+K]+ 305.05508 166.1
[M+H-H2O]+ 249.08918 156.4
[M+HCOO]- 311.09012 186.1
[M+CH3COO]- 325.10577 188.5
[M+Na-2H]- 287.06659 163.6
[M]+ 266.09137 167.6
[M]- 266.09247 167.6
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.