CID 3024329

94333-54-7

Structural Information

Molecular Formula
C17H20N2O3
SMILES
C1COCCN1CCNC(=O)C2=CC3=CC=CC=C3C=C2O
InChI
InChI=1S/C17H20N2O3/c20-16-12-14-4-2-1-3-13(14)11-15(16)17(21)18-5-6-19-7-9-22-10-8-19/h1-4,11-12,20H,5-10H2,(H,18,21)
InChIKey
VWWOEFGPFRRRQO-UHFFFAOYSA-N
Compound name
3-hydroxy-N-(2-morpholin-4-ylethyl)naphthalene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

40
Patents

300.1474 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.154676 169.5
[M+Na]+ 323.136618 173.6
[M-H]- 299.140124 173.9
[M+NH4]+ 318.181223 181.3
[M+K]+ 339.110558 170.4
[M+H-H2O]+ 283.144660 160.3
[M+HCOO]- 345.145601 185.3
[M+CH3COO]- 359.161251 203.0
[M+Na-2H]- 321.122066 174.4
[M]+ 300.14685142 166.3
[M]- 300.14794858 166.3
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