CID 45054560

N-(2-(2-(1-naphthylmethylene)hydrazino)-2-oxoethyl)-4-propoxybenzamide

Structural Information

Molecular Formula
C23H23N3O3
SMILES
CCCOC1=CC=C(C=C1)C(=O)NCC(=O)N/N=C/C2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C23H23N3O3/c1-2-14-29-20-12-10-18(11-13-20)23(28)24-16-22(27)26-25-15-19-8-5-7-17-6-3-4-9-21(17)19/h3-13,15H,2,14,16H2,1H3,(H,24,28)(H,26,27)/b25-15+
InChIKey
BANZZQQDHPTWRZ-MFKUBSTISA-N
Compound name
N-[2-[(2E)-2-(naphthalen-1-ylmethylidene)hydrazinyl]-2-oxoethyl]-4-propoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

389.17395 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 390.18123 192.8
[M+Na]+ 412.16317 196.4
[M-H]- 388.16667 200.6
[M+NH4]+ 407.20777 204.2
[M+K]+ 428.13711 192.1
[M+H-H2O]+ 372.17121 182.3
[M+HCOO]- 434.17215 217.4
[M+CH3COO]- 448.18780 230.1
[M+Na-2H]- 410.14862 197.5
[M]+ 389.17340 194.7
[M]- 389.17450 194.7
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.