CID 46364

64011-96-7

Structural Information

Molecular Formula
C26H22N2O2
SMILES
C1CC(C1C(=O)NC2=CC=CC3=CC=CC=C32)C(=O)NC4=CC=CC5=CC=CC=C54
InChI
InChI=1S/C26H22N2O2/c29-25(27-23-13-5-9-17-7-1-3-11-19(17)23)21-15-16-22(21)26(30)28-24-14-6-10-18-8-2-4-12-20(18)24/h1-14,21-22H,15-16H2,(H,27,29)(H,28,30)
InChIKey
GQMNVHUHWNUGCO-UHFFFAOYSA-N
Compound name
1-N,2-N-dinaphthalen-1-ylcyclobutane-1,2-dicarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

394.16812 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 395.17540 193.5
[M+Na]+ 417.15734 197.2
[M-H]- 393.16084 203.3
[M+NH4]+ 412.20194 198.6
[M+K]+ 433.13128 194.8
[M+H-H2O]+ 377.16538 176.8
[M+HCOO]- 439.16632 212.8
[M+CH3COO]- 453.18197 201.6
[M+Na-2H]- 415.14279 197.9
[M]+ 394.16757 200.4
[M]- 394.16867 200.4
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

No patent data available for this compound.