CID 3076081

Benzamide, n,n'-1,9-nonanediylbis(2-hydroxy-

Structural Information

Molecular Formula
C23H30N2O4
SMILES
C1=CC=C(C(=C1)C(=O)NCCCCCCCCCNC(=O)C2=CC=CC=C2O)O
InChI
InChI=1S/C23H30N2O4/c26-20-14-8-6-12-18(20)22(28)24-16-10-4-2-1-3-5-11-17-25-23(29)19-13-7-9-15-21(19)27/h6-9,12-15,26-27H,1-5,10-11,16-17H2,(H,24,28)(H,25,29)
InChIKey
BKRVEXJQEGMTGK-UHFFFAOYSA-N
Compound name
2-hydroxy-N-[9-[(2-hydroxybenzoyl)amino]nonyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

398.22055 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 399.22783 198.5
[M+Na]+ 421.20977 199.9
[M-H]- 397.21327 201.1
[M+NH4]+ 416.25437 207.0
[M+K]+ 437.18371 194.9
[M+H-H2O]+ 381.21781 189.0
[M+HCOO]- 443.21875 218.0
[M+CH3COO]- 457.23440 223.8
[M+Na-2H]- 419.19522 198.1
[M]+ 398.22000 199.2
[M]- 398.22110 199.2
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.