CID 44236

N-(2-dimethylaminoethyl)-4-methylbenzamidine dihydrochloride

Structural Information

Molecular Formula
C12H19N3
SMILES
CC1=CC=C(C=C1)C(=NCCN(C)C)N
InChI
InChI=1S/C12H19N3/c1-10-4-6-11(7-5-10)12(13)14-8-9-15(2)3/h4-7H,8-9H2,1-3H3,(H2,13,14)
InChIKey
FCKZPFBSTBAPHW-UHFFFAOYSA-N
Compound name
N'-[2-(dimethylamino)ethyl]-4-methylbenzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.1579 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.16518 149.5
[M+Na]+ 228.14712 154.7
[M-H]- 204.15062 155.2
[M+NH4]+ 223.19172 168.8
[M+K]+ 244.12106 153.8
[M+H-H2O]+ 188.15516 142.0
[M+HCOO]- 250.15610 176.7
[M+CH3COO]- 264.17175 201.0
[M+Na-2H]- 226.13257 153.6
[M]+ 205.15735 149.3
[M]- 205.15845 149.3
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.