CID 33902

M-acetanisidide, 2-(p-butoxyphenoxy)-n-(3-(diethylamino)propyl)-, monohydrochloride

Structural Information

Molecular Formula
C26H38N2O4
SMILES
CCCCOC1=CC=C(C=C1)OCC(=O)N(CCCN(CC)CC)C2=CC(=CC=C2)OC
InChI
InChI=1S/C26H38N2O4/c1-5-8-19-31-23-13-15-24(16-14-23)32-21-26(29)28(18-10-17-27(6-2)7-3)22-11-9-12-25(20-22)30-4/h9,11-16,20H,5-8,10,17-19,21H2,1-4H3
InChIKey
PGDRAROYOSEURI-UHFFFAOYSA-N
Compound name
2-(4-butoxyphenoxy)-N-[3-(diethylamino)propyl]-N-(3-methoxyphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

442.28317 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 443.29045 213.0
[M+Na]+ 465.27239 222.7
[M+NH4]+ 460.31699 218.2
[M+K]+ 481.24633 215.2
[M-H]- 441.27589 217.3
[M+Na-2H]- 463.25784 218.7
[M]+ 442.28262 215.4
[M]- 442.28372 215.4
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.