CID 103147

65072-61-9

Structural Information

Molecular Formula
C30H29N3O5
SMILES
CCCCOC(=O)C1=CC=CC=C1N=NC2=C(C(=CC3=CC=CC=C32)C(=O)NC4=CC=CC=C4OCC)O
InChI
InChI=1S/C30H29N3O5/c1-3-5-18-38-30(36)22-14-8-9-15-24(22)32-33-27-21-13-7-6-12-20(21)19-23(28(27)34)29(35)31-25-16-10-11-17-26(25)37-4-2/h6-17,19,34H,3-5,18H2,1-2H3,(H,31,35)
InChIKey
YNXQJRAPEYVIRV-UHFFFAOYSA-N
Compound name
butyl 2-[[3-[(2-ethoxyphenyl)carbamoyl]-2-hydroxynaphthalen-1-yl]diazenyl]benzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

511.21072 Da
Monoisotopic Mass

7.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 512.21800 227.4
[M+Na]+ 534.19994 240.3
[M+NH4]+ 529.24454 232.5
[M+K]+ 550.17388 231.6
[M-H]- 510.20344 234.8
[M+Na-2H]- 532.18539 235.5
[M]+ 511.21017 231.2
[M]- 511.21127 231.2
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.