CID 59672

4-amino-n-(2-(diethylamino)ethyl)-2-propoxy-benzamide hydrochloride

Structural Information

Molecular Formula
C16H27N3O2
SMILES
CCCOC1=C(C=CC(=C1)N)C(=O)NCCN(CC)CC
InChI
InChI=1S/C16H27N3O2/c1-4-11-21-15-12-13(17)7-8-14(15)16(20)18-9-10-19(5-2)6-3/h7-8,12H,4-6,9-11,17H2,1-3H3,(H,18,20)
InChIKey
KUDYDMFOUUNRGN-UHFFFAOYSA-N
Compound name
4-amino-N-[2-(diethylamino)ethyl]-2-propoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

293.21033 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.21761 173.8
[M+Na]+ 316.19955 177.5
[M-H]- 292.20305 177.6
[M+NH4]+ 311.24415 188.9
[M+K]+ 332.17349 176.0
[M+H-H2O]+ 276.20759 165.5
[M+HCOO]- 338.20853 198.5
[M+CH3COO]- 352.22418 216.0
[M+Na-2H]- 314.18500 174.6
[M]+ 293.20978 176.3
[M]- 293.21088 176.3
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

patents stripe