CID 6436667

25383-06-6

Structural Information

Molecular Formula
C3H7O3P
SMILES
C/C=C\P(=O)(O)O
InChI
InChI=1S/C3H7O3P/c1-2-3-7(4,5)6/h2-3H,1H3,(H2,4,5,6)/b3-2-
InChIKey
XWCIXXXLOAAWPU-IHWYPQMZSA-N
Compound name
[(Z)-prop-1-enyl]phosphonic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

385
Patents

122.01328 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 123.020556 125.0
[M+Na]+ 145.002498 133.2
[M-H]- 121.006004 121.9
[M+NH4]+ 140.047103 146.7
[M+K]+ 160.976438 132.1
[M+H-H2O]+ 105.010540 119.6
[M+HCOO]- 167.011481 151.3
[M+CH3COO]- 181.027131 163.3
[M+Na-2H]- 142.987946 129.5
[M]+ 122.01273142 125.3
[M]- 122.01382858 125.3
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