CID 16227682

929974-73-2

Structural Information

Molecular Formula
C17H14N2O2
SMILES
C1C(C1(C2=NC3=CC=CC=C3N2)C(=O)O)C4=CC=CC=C4
InChI
InChI=1S/C17H14N2O2/c20-16(21)17(10-12(17)11-6-2-1-3-7-11)15-18-13-8-4-5-9-14(13)19-15/h1-9,12H,10H2,(H,18,19)(H,20,21)
InChIKey
YCEPLRVNXFMJJG-UHFFFAOYSA-N
Compound name
1-(1H-benzimidazol-2-yl)-2-phenylcyclopropane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

278.10553 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.11281 168.4
[M+Na]+ 301.09475 184.5
[M+NH4]+ 296.13935 178.2
[M+K]+ 317.06869 178.3
[M-H]- 277.09825 179.3
[M+Na-2H]- 299.08020 180.4
[M]+ 278.10498 175.2
[M]- 278.10608 175.2
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.