CID 457315

2-naphthalenecarboxamide, 3-hydroxy-n-(2-phenylethyl)-

Structural Information

Molecular Formula
C19H17NO2
SMILES
C1=CC=C(C=C1)CCNC(=O)C2=CC3=CC=CC=C3C=C2O
InChI
InChI=1S/C19H17NO2/c21-18-13-16-9-5-4-8-15(16)12-17(18)19(22)20-11-10-14-6-2-1-3-7-14/h1-9,12-13,21H,10-11H2,(H,20,22)
InChIKey
GQKGRRUIPGTYCC-UHFFFAOYSA-N
Compound name
3-hydroxy-N-(2-phenylethyl)naphthalene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

291.12592 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.13320 167.1
[M+Na]+ 314.11514 173.4
[M-H]- 290.11864 173.1
[M+NH4]+ 309.15974 182.2
[M+K]+ 330.08908 167.9
[M+H-H2O]+ 274.12318 158.9
[M+HCOO]- 336.12412 188.7
[M+CH3COO]- 350.13977 203.0
[M+Na-2H]- 312.10059 173.1
[M]+ 291.12537 166.3
[M]- 291.12647 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

No patent data available for this compound.