CID 84717816

Methyl[(2-methyl-2h-1,2,3-benzotriazol-4-yl)methyl]amine hydrochloride

Structural Information

Molecular Formula
C9H12N4
SMILES
CNCC1=CC=CC2=NN(N=C21)C
InChI
InChI=1S/C9H12N4/c1-10-6-7-4-3-5-8-9(7)12-13(2)11-8/h3-5,10H,6H2,1-2H3
InChIKey
OJHWRYZVGJZTNL-UHFFFAOYSA-N
Compound name
N-methyl-1-(2-methylbenzotriazol-4-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

176.1062 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.11348 136.0
[M+Na]+ 199.09542 149.6
[M+NH4]+ 194.14002 144.3
[M+K]+ 215.06936 144.7
[M-H]- 175.09892 137.6
[M+Na-2H]- 197.08087 143.2
[M]+ 176.10565 138.3
[M]- 176.10675 138.3
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

No patent data available for this compound.