CID 3078828

Benzamide, n-((4-(2-(dimethylamino)ethoxy)phenyl)methyl)-3-methyl-, monohydrochloride

Structural Information

Molecular Formula
C19H24N2O2
SMILES
CC1=CC(=CC=C1)C(=O)NCC2=CC=C(C=C2)OCCN(C)C
InChI
InChI=1S/C19H24N2O2/c1-15-5-4-6-17(13-15)19(22)20-14-16-7-9-18(10-8-16)23-12-11-21(2)3/h4-10,13H,11-12,14H2,1-3H3,(H,20,22)
InChIKey
XATZYUMBUYOTMR-UHFFFAOYSA-N
Compound name
N-[[4-[2-(dimethylamino)ethoxy]phenyl]methyl]-3-methylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

312.18378 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.19106 176.7
[M+Na]+ 335.17300 181.2
[M-H]- 311.17650 184.2
[M+NH4]+ 330.21760 191.2
[M+K]+ 351.14694 178.6
[M+H-H2O]+ 295.18104 167.5
[M+HCOO]- 357.18198 201.5
[M+CH3COO]- 371.19763 216.0
[M+Na-2H]- 333.15845 179.3
[M]+ 312.18323 179.5
[M]- 312.18433 179.5
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.