CID 424321

2-aminomethyl-5,6-dimethylbenzimidazole hydrochloride

Structural Information

Molecular Formula
C10H13N3
SMILES
CC1=CC2=C(C=C1C)N=C(N2)CN
InChI
InChI=1S/C10H13N3/c1-6-3-8-9(4-7(6)2)13-10(5-11)12-8/h3-4H,5,11H2,1-2H3,(H,12,13)
InChIKey
YVGNMPOXSOIKSS-UHFFFAOYSA-N
Compound name
(5,6-dimethyl-1H-benzimidazol-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

175.11095 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.11823 137.3
[M+Na]+ 198.10017 148.4
[M-H]- 174.10367 138.6
[M+NH4]+ 193.14477 157.5
[M+K]+ 214.07411 143.7
[M+H-H2O]+ 158.10821 130.8
[M+HCOO]- 220.10915 160.0
[M+CH3COO]- 234.12480 150.9
[M+Na-2H]- 196.08562 143.4
[M]+ 175.11040 137.3
[M]- 175.11150 137.3
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