CID 126500423

2072108-68-8

Structural Information

Molecular Formula
C20H18N2O2
SMILES
CC1=C(C2=CC=CC=C2C=C1)NC(=O)C(=O)NCC3=CC=CC=C3
InChI
InChI=1S/C20H18N2O2/c1-14-11-12-16-9-5-6-10-17(16)18(14)22-20(24)19(23)21-13-15-7-3-2-4-8-15/h2-12H,13H2,1H3,(H,21,23)(H,22,24)
InChIKey
QOOOSPCWFVCKFK-UHFFFAOYSA-N
Compound name
N-benzyl-N'-(2-methylnaphthalen-1-yl)oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

68
Patents

318.13684 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.14412 174.7
[M+Na]+ 341.12606 180.1
[M-H]- 317.12956 181.9
[M+NH4]+ 336.17066 189.0
[M+K]+ 357.10000 175.3
[M+H-H2O]+ 301.13410 165.8
[M+HCOO]- 363.13504 197.6
[M+CH3COO]- 377.15069 212.3
[M+Na-2H]- 339.11151 179.8
[M]+ 318.13629 173.9
[M]- 318.13739 173.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe