CID 43919

Dan-2807

Structural Information

Molecular Formula
C26H30N2O3
SMILES
CC(COC1=CC=C(C=C1)NC(=O)C)NCCOC(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C26H30N2O3/c1-20(19-31-25-15-13-24(14-16-25)28-21(2)29)27-17-18-30-26(22-9-5-3-6-10-22)23-11-7-4-8-12-23/h3-16,20,26-27H,17-19H2,1-2H3,(H,28,29)
InChIKey
KEQFOADHIFFDQH-UHFFFAOYSA-N
Compound name
N-[4-[2-(2-benzhydryloxyethylamino)propoxy]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

418.22565 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 419.23293 204.2
[M+Na]+ 441.21487 204.7
[M-H]- 417.21837 212.0
[M+NH4]+ 436.25947 212.2
[M+K]+ 457.18881 200.7
[M+H-H2O]+ 401.22291 192.8
[M+HCOO]- 463.22385 225.3
[M+CH3COO]- 477.23950 231.9
[M+Na-2H]- 439.20032 205.0
[M]+ 418.22510 205.0
[M]- 418.22620 205.0
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.