CID 43148777

1-(cyclopropylmethyl)-1h-1,3-benzodiazol-2-amine

Structural Information

Molecular Formula
C11H13N3
SMILES
C1CC1CN2C3=CC=CC=C3N=C2N
InChI
InChI=1S/C11H13N3/c12-11-13-9-3-1-2-4-10(9)14(11)7-8-5-6-8/h1-4,8H,5-7H2,(H2,12,13)
InChIKey
WWFYTACYBRMYFI-UHFFFAOYSA-N
Compound name
1-(cyclopropylmethyl)benzimidazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

187.11095 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.11823 141.4
[M+Na]+ 210.10017 156.2
[M+NH4]+ 205.14477 151.0
[M+K]+ 226.07411 152.1
[M-H]- 186.10367 151.8
[M+Na-2H]- 208.08562 151.5
[M]+ 187.11040 147.5
[M]- 187.11150 147.5
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

patents stripe