CID 66717

2-naphthalenecarboxamide, n-(2,4-dimethylphenyl)-3-hydroxy-

Structural Information

Molecular Formula
C19H17NO2
SMILES
CC1=CC(=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C=C2O)C
InChI
InChI=1S/C19H17NO2/c1-12-7-8-17(13(2)9-12)20-19(22)16-10-14-5-3-4-6-15(14)11-18(16)21/h3-11,21H,1-2H3,(H,20,22)
InChIKey
VTPSNRIENVXKCI-UHFFFAOYSA-N
Compound name
N-(2,4-dimethylphenyl)-3-hydroxynaphthalene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

469
Patents

291.12592 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.13320 167.6
[M+Na]+ 314.11514 175.7
[M-H]- 290.11864 174.4
[M+NH4]+ 309.15974 183.4
[M+K]+ 330.08908 170.4
[M+H-H2O]+ 274.12318 159.7
[M+HCOO]- 336.12412 189.1
[M+CH3COO]- 350.13977 205.4
[M+Na-2H]- 312.10059 172.0
[M]+ 291.12537 167.6
[M]- 291.12647 167.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe