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]+ 272.13936 161.7
[M+Na]+ 294.12130 166.9
[M-H]- 270.12480 166.7
[M+NH4]+ 289.16590 175.5
[M+K]+ 310.09524 163.5
[M+H-H2O]+ 254.12934 152.3
[M+HCOO]- 316.13028 186.1
[M+CH3COO]- 330.14593 202.2
[M+Na-2H]- 292.10675 168.3
[M]+ 271.13153 162.0
[M]- 271.13263 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.