CID 9626828

N-(2-(2-(9-anthrylmethylene)hydrazino)-2-oxoethyl)-2-methylbenzamide

Structural Information

Molecular Formula
C25H21N3O2
SMILES
CC1=CC=CC=C1C(=O)NCC(=O)N/N=C/C2=C3C=CC=CC3=CC4=CC=CC=C42
InChI
InChI=1S/C25H21N3O2/c1-17-8-2-5-11-20(17)25(30)26-16-24(29)28-27-15-23-21-12-6-3-9-18(21)14-19-10-4-7-13-22(19)23/h2-15H,16H2,1H3,(H,26,30)(H,28,29)/b27-15+
InChIKey
OANQANDYSXIFHP-JFLMPSFJSA-N
Compound name
N-[2-[(2E)-2-(anthracen-9-ylmethylidene)hydrazinyl]-2-oxoethyl]-2-methylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

395.1634 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 396.17068 196.3
[M+Na]+ 418.15262 211.0
[M+NH4]+ 413.19722 204.2
[M+K]+ 434.12656 201.1
[M-H]- 394.15612 203.8
[M+Na-2H]- 416.13807 205.7
[M]+ 395.16285 200.5
[M]- 395.16395 200.5
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.