CID 216218

Fepromide

Structural Information

Molecular Formula
C23H30N2O5
SMILES
COC1=CC(=CC(=C1OC)OC)C(=O)NC(CN2CCCC2)COC3=CC=CC=C3
InChI
InChI=1S/C23H30N2O5/c1-27-20-13-17(14-21(28-2)22(20)29-3)23(26)24-18(15-25-11-7-8-12-25)16-30-19-9-5-4-6-10-19/h4-6,9-10,13-14,18H,7-8,11-12,15-16H2,1-3H3,(H,24,26)
InChIKey
QFSBWEZVTZCUPC-UHFFFAOYSA-N
Compound name
3,4,5-trimethoxy-N-(1-phenoxy-3-pyrrolidin-1-ylpropan-2-yl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
Patents

414.21548 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 415.22276 199.7
[M+Na]+ 437.20470 202.0
[M-H]- 413.20820 207.1
[M+NH4]+ 432.24930 209.3
[M+K]+ 453.17864 199.8
[M+H-H2O]+ 397.21274 189.2
[M+HCOO]- 459.21368 219.0
[M+CH3COO]- 473.22933 226.9
[M+Na-2H]- 435.19015 197.4
[M]+ 414.21493 203.1
[M]- 414.21603 203.1
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.