CID 43661573

1-ethyl-5-methyl-1h-1,3-benzodiazol-2-amine

Structural Information

Molecular Formula
C10H13N3
SMILES
CCN1C2=C(C=C(C=C2)C)N=C1N
InChI
InChI=1S/C10H13N3/c1-3-13-9-5-4-7(2)6-8(9)12-10(13)11/h4-6H,3H2,1-2H3,(H2,11,12)
InChIKey
PUJYJVOXWBLSSF-UHFFFAOYSA-N
Compound name
1-ethyl-5-methylbenzimidazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

175.11095 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.11823 136.7
[M+Na]+ 198.10017 148.3
[M-H]- 174.10367 139.4
[M+NH4]+ 193.14477 157.7
[M+K]+ 214.07411 144.5
[M+H-H2O]+ 158.10821 129.9
[M+HCOO]- 220.10915 161.0
[M+CH3COO]- 234.12480 151.1
[M+Na-2H]- 196.08562 143.3
[M]+ 175.11040 138.6
[M]- 175.11150 138.6
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

patents stripe