CID 3076079

Brn 3624621

Structural Information

Molecular Formula
C19H22N2O4
SMILES
C1=CC=C(C(=C1)C(=O)NCCCCCNC(=O)C2=CC=CC=C2O)O
InChI
InChI=1S/C19H22N2O4/c22-16-10-4-2-8-14(16)18(24)20-12-6-1-7-13-21-19(25)15-9-3-5-11-17(15)23/h2-5,8-11,22-23H,1,6-7,12-13H2,(H,20,24)(H,21,25)
InChIKey
PYVNJYHJVKTEIL-UHFFFAOYSA-N
Compound name
2-hydroxy-N-[5-[(2-hydroxybenzoyl)amino]pentyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

342.15796 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.16524 181.1
[M+Na]+ 365.14718 184.3
[M-H]- 341.15068 184.4
[M+NH4]+ 360.19178 191.9
[M+K]+ 381.12112 180.1
[M+H-H2O]+ 325.15522 172.3
[M+HCOO]- 387.15616 201.9
[M+CH3COO]- 401.17181 212.0
[M+Na-2H]- 363.13263 182.6
[M]+ 342.15741 180.4
[M]- 342.15851 180.4
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