CID 64894

Cr 592

Structural Information

Molecular Formula
C26H37N3O3
SMILES
CCCN(CCC)C(=O)C(CC1=CC=C(C=C1)OCCN(C)C)NC(=O)C2=CC=CC=C2
InChI
InChI=1S/C26H37N3O3/c1-5-16-29(17-6-2)26(31)24(27-25(30)22-10-8-7-9-11-22)20-21-12-14-23(15-13-21)32-19-18-28(3)4/h7-15,24H,5-6,16-20H2,1-4H3,(H,27,30)
InChIKey
LQQUBKVPFCJVIO-UHFFFAOYSA-N
Compound name
N-[3-[4-[2-(dimethylamino)ethoxy]phenyl]-1-(dipropylamino)-1-oxopropan-2-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

439.28348 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 440.29076 212.7
[M+Na]+ 462.27270 220.5
[M+NH4]+ 457.31730 217.4
[M+K]+ 478.24664 214.3
[M-H]- 438.27620 216.9
[M+Na-2H]- 460.25815 217.9
[M]+ 439.28293 214.6
[M]- 439.28403 214.6
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.