CID 6335602

4392-98-7

Structural Information

Molecular Formula
C7H7O2P
SMILES
C1=CC=C(C=C1)C(O)P=O
InChI
InChI=1S/C7H7O2P/c8-7(10-9)6-4-2-1-3-5-6/h1-5,7-8H
InChIKey
FZFMLCXMZPZMAD-UHFFFAOYSA-N
Compound name
phenyl(phosphoroso)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

154.01837 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.025646 131.6
[M+Na]+ 177.007588 138.9
[M-H]- 153.011094 132.9
[M+NH4]+ 172.052193 152.3
[M+K]+ 192.981528 137.3
[M+H-H2O]+ 137.015630 124.1
[M+HCOO]- 199.016571 160.1
[M+CH3COO]- 213.032221 173.5
[M+Na-2H]- 174.993036 135.0
[M]+ 154.01782142 131.9
[M]- 154.01891858 131.9
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

patents stripe