CID 3065789

Phosphinic acid, (p-aminophenyl)phenyl-

Structural Information

Molecular Formula
C12H12NO2P
SMILES
C1=CC=C(C=C1)P(=O)(C2=CC=C(C=C2)N)O
InChI
InChI=1S/C12H12NO2P/c13-10-6-8-12(9-7-10)16(14,15)11-4-2-1-3-5-11/h1-9H,13H2,(H,14,15)
InChIKey
SNJJVDVIZVIEMA-UHFFFAOYSA-N
Compound name
(4-aminophenyl)-phenylphosphinic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

233.06056 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.06784 152.2
[M+Na]+ 256.04978 159.2
[M-H]- 232.05328 156.2
[M+NH4]+ 251.09438 169.1
[M+K]+ 272.02372 155.4
[M+H-H2O]+ 216.05782 143.2
[M+HCOO]- 278.05876 180.1
[M+CH3COO]- 292.07441 189.5
[M+Na-2H]- 254.03523 156.0
[M]+ 233.06001 150.1
[M]- 233.06111 150.1
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