CID 90314

23966-76-9

Structural Information

Molecular Formula
C18H30N2O3
SMILES
CCCOC1=C(C=CC=C1OC)C(=O)NCCCN(CC)CC
InChI
InChI=1S/C18H30N2O3/c1-5-14-23-17-15(10-8-11-16(17)22-4)18(21)19-12-9-13-20(6-2)7-3/h8,10-11H,5-7,9,12-14H2,1-4H3,(H,19,21)
InChIKey
HACPRLCAJJBMIZ-UHFFFAOYSA-N
Compound name
N-[3-(diethylamino)propyl]-3-methoxy-2-propoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

322.22565 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.23293 181.7
[M+Na]+ 345.21487 185.3
[M-H]- 321.21837 185.6
[M+NH4]+ 340.25947 196.2
[M+K]+ 361.18881 184.2
[M+H-H2O]+ 305.22291 173.2
[M+HCOO]- 367.22385 205.6
[M+CH3COO]- 381.23950 219.4
[M+Na-2H]- 343.20032 182.2
[M]+ 322.22510 188.2
[M]- 322.22620 188.2
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.