CID 10559140

1-cyclopropyl-2,3-dihydro-1h-1,3-benzodiazol-2-one

Structural Information

Molecular Formula
C10H10N2O
SMILES
C1CC1N2C3=CC=CC=C3NC2=O
InChI
InChI=1S/C10H10N2O/c13-10-11-8-3-1-2-4-9(8)12(10)7-5-6-7/h1-4,7H,5-6H2,(H,11,13)
InChIKey
BUPOQYUUGOFEAD-UHFFFAOYSA-N
Compound name
3-cyclopropyl-1H-benzimidazol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

69
Patents

174.07932 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.086596 138.5
[M+Na]+ 197.068538 151.5
[M-H]- 173.072044 143.7
[M+NH4]+ 192.113143 153.8
[M+K]+ 213.042478 145.6
[M+H-H2O]+ 157.076580 131.4
[M+HCOO]- 219.077521 161.4
[M+CH3COO]- 233.093171 152.1
[M+Na-2H]- 195.053986 145.5
[M]+ 174.07877142 141.2
[M]- 174.07986858 141.2
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