CID 28707416

N-(2-aminoethyl)-n-methylbenzamide hydrochloride

Structural Information

Molecular Formula
C10H14N2O
SMILES
CN(CCN)C(=O)C1=CC=CC=C1
InChI
InChI=1S/C10H14N2O/c1-12(8-7-11)10(13)9-5-3-2-4-6-9/h2-6H,7-8,11H2,1H3
InChIKey
AGUGTVMQPNPBDL-UHFFFAOYSA-N
Compound name
N-(2-aminoethyl)-N-methylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

178.11061 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.117886 139.9
[M+Na]+ 201.099828 145.4
[M-H]- 177.103334 144.3
[M+NH4]+ 196.144433 159.6
[M+K]+ 217.073768 144.6
[M+H-H2O]+ 161.107870 133.1
[M+HCOO]- 223.108811 165.5
[M+CH3COO]- 237.124461 188.2
[M+Na-2H]- 199.085276 145.1
[M]+ 178.11006142 138.9
[M]- 178.11115858 138.9
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