CID 2164827

Benzamide, 4-chloro-n-(3-(diethylamino)propyl)-, monohydrochloride

Structural Information

Molecular Formula
C14H21ClN2O
SMILES
CCN(CC)CCCNC(=O)C1=CC=C(C=C1)Cl
InChI
InChI=1S/C14H21ClN2O/c1-3-17(4-2)11-5-10-16-14(18)12-6-8-13(15)9-7-12/h6-9H,3-5,10-11H2,1-2H3,(H,16,18)
InChIKey
LUAVKSCUFPXOFE-UHFFFAOYSA-N
Compound name
4-chloro-N-[3-(diethylamino)propyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.13425 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.141526 164.7
[M+Na]+ 291.123468 170.2
[M-H]- 267.126974 169.0
[M+NH4]+ 286.168073 182.2
[M+K]+ 307.097408 166.7
[M+H-H2O]+ 251.131510 158.2
[M+HCOO]- 313.132451 185.1
[M+CH3COO]- 327.148101 205.8
[M+Na-2H]- 289.108916 167.5
[M]+ 268.13370142 168.7
[M]- 268.13479858 168.7
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.