CID 3071654

N-(2-(7-methoxynaphth-1-yl)ethyl)-2-imidazolinone-4-carboxamide

Structural Information

Molecular Formula
C17H17N3O3
SMILES
COC1=CC2=C(C=CC=C2CCNC(=O)C3=NC(=O)NC3)C=C1
InChI
InChI=1S/C17H17N3O3/c1-23-13-6-5-11-3-2-4-12(14(11)9-13)7-8-18-16(21)15-10-19-17(22)20-15/h2-6,9H,7-8,10H2,1H3,(H,18,21)(H,19,22)
InChIKey
BCBJOMAYLHQYKN-UHFFFAOYSA-N
Compound name
N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-oxo-1,5-dihydroimidazole-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

311.12698 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.13426 171.5
[M+Na]+ 334.11620 178.4
[M-H]- 310.11970 175.2
[M+NH4]+ 329.16080 185.0
[M+K]+ 350.09014 173.4
[M+H-H2O]+ 294.12424 162.5
[M+HCOO]- 356.12518 190.8
[M+CH3COO]- 370.14083 205.1
[M+Na-2H]- 332.10165 174.4
[M]+ 311.12643 171.5
[M]- 311.12753 171.5
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

patents stripe