CID 72023225

1385394-67-1

Structural Information

Molecular Formula
C15H17N3O2
SMILES
CC(=O)NC1=CC(=CC=C1)OCCNC2=CC=CC=N2
InChI
InChI=1S/C15H17N3O2/c1-12(19)18-13-5-4-6-14(11-13)20-10-9-17-15-7-2-3-8-16-15/h2-8,11H,9-10H2,1H3,(H,16,17)(H,18,19)
InChIKey
ASJQCAMLFOWZIQ-UHFFFAOYSA-N
Compound name
N-[3-[2-(pyridin-2-ylamino)ethoxy]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

271.13208 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.139356 161.7
[M+Na]+ 294.121298 166.9
[M-H]- 270.124804 166.7
[M+NH4]+ 289.165903 175.5
[M+K]+ 310.095238 163.5
[M+H-H2O]+ 254.129340 152.3
[M+HCOO]- 316.130281 186.1
[M+CH3COO]- 330.145931 202.2
[M+Na-2H]- 292.106746 168.3
[M]+ 271.13153142 162.0
[M]- 271.13262858 162.0
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.