CID 254913

N-(1-naphthyl)-1-aziridinecarboxamide

Structural Information

Molecular Formula
C13H12N2O
SMILES
C1CN1C(=O)NC2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C13H12N2O/c16-13(15-8-9-15)14-12-7-3-5-10-4-1-2-6-11(10)12/h1-7H,8-9H2,(H,14,16)
InChIKey
FSJAKBJXFPNYGO-UHFFFAOYSA-N
Compound name
N-naphthalen-1-ylaziridine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

212.09496 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.102236 147.1
[M+Na]+ 235.084178 156.3
[M-H]- 211.087684 154.0
[M+NH4]+ 230.128783 160.3
[M+K]+ 251.058118 151.8
[M+H-H2O]+ 195.092220 139.3
[M+HCOO]- 257.093161 170.0
[M+CH3COO]- 271.108811 159.4
[M+Na-2H]- 233.069626 155.1
[M]+ 212.09441142 148.3
[M]- 212.09550858 148.3
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