CID 82417237

1-methyl-4,5,6,7-tetrahydro-1h-1,3-benzodiazol-6-amine dihydrochloride

Structural Information

Molecular Formula
C8H13N3
SMILES
CN1C=NC2=C1CC(CC2)N
InChI
InChI=1S/C8H13N3/c1-11-5-10-7-3-2-6(9)4-8(7)11/h5-6H,2-4,9H2,1H3
InChIKey
QFOGPABVGAOTCZ-UHFFFAOYSA-N
Compound name
3-methyl-4,5,6,7-tetrahydrobenzimidazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

151.11095 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.11823 131.4
[M+Na]+ 174.10017 142.4
[M+NH4]+ 169.14477 140.4
[M+K]+ 190.07411 138.3
[M-H]- 150.10367 133.1
[M+Na-2H]- 172.08562 136.1
[M]+ 151.11040 133.2
[M]- 151.11150 133.2
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.