CID 3061756

Brn 5566808

Structural Information

Molecular Formula
C15H14N2O2
SMILES
CN1C2=C(C=C(C=C2)OC)N(C1=O)C3=CC=CC=C3
InChI
InChI=1S/C15H14N2O2/c1-16-13-9-8-12(19-2)10-14(13)17(15(16)18)11-6-4-3-5-7-11/h3-10H,1-2H3
InChIKey
MMDCLEZHHLTKEI-UHFFFAOYSA-N
Compound name
5-methoxy-1-methyl-3-phenylbenzimidazol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

254.10553 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.11281 155.4
[M+Na]+ 277.09475 167.8
[M-H]- 253.09825 162.0
[M+NH4]+ 272.13935 173.2
[M+K]+ 293.06869 163.1
[M+H-H2O]+ 237.10279 147.1
[M+HCOO]- 299.10373 179.4
[M+CH3COO]- 313.11938 169.4
[M+Na-2H]- 275.08020 161.3
[M]+ 254.10498 160.6
[M]- 254.10608 160.6
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.