CID 21325

5254-41-1

Structural Information

Molecular Formula
C21H20N2O3
SMILES
CC(=O)NC1=CC=CC=C1CCNC(=O)C2=C(C3=CC=CC=C3C=C2)O
InChI
InChI=1S/C21H20N2O3/c1-14(24)23-19-9-5-3-7-16(19)12-13-22-21(26)18-11-10-15-6-2-4-8-17(15)20(18)25/h2-11,25H,12-13H2,1H3,(H,22,26)(H,23,24)
InChIKey
HNLJTZUJURZMTN-UHFFFAOYSA-N
Compound name
N-[2-(2-acetamidophenyl)ethyl]-1-hydroxynaphthalene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

68
Patents

348.1474 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.15468 183.9
[M+Na]+ 371.13662 196.3
[M+NH4]+ 366.18122 190.7
[M+K]+ 387.11056 189.0
[M-H]- 347.14012 188.7
[M+Na-2H]- 369.12207 191.0
[M]+ 348.14685 186.9
[M]- 348.14795 186.9
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

patents stripe