CID 82184447

4-bromo-6-methyl-2,3-dihydro-1h-1,3-benzodiazol-2-one

Structural Information

Molecular Formula
C8H7BrN2O
SMILES
CC1=CC2=C(C(=C1)Br)NC(=O)N2
InChI
InChI=1S/C8H7BrN2O/c1-4-2-5(9)7-6(3-4)10-8(12)11-7/h2-3H,1H3,(H2,10,11,12)
InChIKey
FYBZHJVKBRGJRF-UHFFFAOYSA-N
Compound name
4-bromo-6-methyl-1,3-dihydrobenzimidazol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.97418 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.98146 142.6
[M+Na]+ 248.96340 146.9
[M+NH4]+ 244.00800 146.9
[M+K]+ 264.93734 148.3
[M-H]- 224.96690 141.6
[M+Na-2H]- 246.94885 144.9
[M]+ 225.97363 141.6
[M]- 225.97473 141.6
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.