CID 481481

N-(4-ethynylphenyl)(3-hydroxy(2-naphthyl))carboxamide

Structural Information

Molecular Formula
C19H13NO2
SMILES
C#CC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C=C2O
InChI
InChI=1S/C19H13NO2/c1-2-13-7-9-16(10-8-13)20-19(22)17-11-14-5-3-4-6-15(14)12-18(17)21/h1,3-12,21H,(H,20,22)
InChIKey
OKHCPGMDTVRSSD-UHFFFAOYSA-N
Compound name
N-(4-ethynylphenyl)-3-hydroxynaphthalene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

287.09464 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.10192 175.1
[M+Na]+ 310.08386 185.6
[M-H]- 286.08736 178.8
[M+NH4]+ 305.12846 188.6
[M+K]+ 326.05780 176.3
[M+H-H2O]+ 270.09190 161.6
[M+HCOO]- 332.09284 190.7
[M+CH3COO]- 346.10849 184.2
[M+Na-2H]- 308.06931 178.1
[M]+ 287.09409 168.3
[M]- 287.09519 168.3
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

No patent data available for this compound.