CID 74593

Naphtanilide gr

Structural Information

Molecular Formula
C22H17NO2
SMILES
CC1=CC=CC=C1NC(=O)C2=CC3=CC4=CC=CC=C4C=C3C=C2O
InChI
InChI=1S/C22H17NO2/c1-14-6-2-5-9-20(14)23-22(25)19-12-17-10-15-7-3-4-8-16(15)11-18(17)13-21(19)24/h2-13,24H,1H3,(H,23,25)
InChIKey
XCDIDHPTOCAKAB-UHFFFAOYSA-N
Compound name
3-hydroxy-N-(2-methylphenyl)anthracene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

38
Patents

327.12592 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.13320 176.1
[M+Na]+ 350.11514 185.0
[M-H]- 326.11864 183.8
[M+NH4]+ 345.15974 191.1
[M+K]+ 366.08908 178.4
[M+H-H2O]+ 310.12318 167.3
[M+HCOO]- 372.12412 197.4
[M+CH3COO]- 386.13977 187.3
[M+Na-2H]- 348.10059 183.0
[M]+ 327.12537 177.1
[M]- 327.12647 177.1
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