CID 134613

Diphenylhydantoic acid

Structural Information

Molecular Formula
C15H14N2O3
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)O)NC(=O)N
InChI
InChI=1S/C15H14N2O3/c16-14(20)17-15(13(18)19,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,(H,18,19)(H3,16,17,20)
InChIKey
UESCARMREGSPTP-UHFFFAOYSA-N
Compound name
2-(carbamoylamino)-2,2-diphenylacetic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

55
Patents

270.10043 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.107706 160.0
[M+Na]+ 293.089648 164.2
[M-H]- 269.093154 164.5
[M+NH4]+ 288.134253 173.8
[M+K]+ 309.063588 160.9
[M+H-H2O]+ 253.097690 152.4
[M+HCOO]- 315.098631 181.4
[M+CH3COO]- 329.114281 198.0
[M+Na-2H]- 291.075096 165.3
[M]+ 270.09988142 156.1
[M]- 270.10097858 156.1
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