CID 57560

N-(1-naphthyl)-1-aziridinepropionamide

Structural Information

Molecular Formula
C15H16N2O
SMILES
C1CN1CCC(=O)NC2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C15H16N2O/c18-15(8-9-17-10-11-17)16-14-7-3-5-12-4-1-2-6-13(12)14/h1-7H,8-11H2,(H,16,18)
InChIKey
HIZHLBPUJWMUCD-UHFFFAOYSA-N
Compound name
3-(aziridin-1-yl)-N-naphthalen-1-ylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.12627 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.13355 155.3
[M+Na]+ 263.11549 163.6
[M-H]- 239.11899 161.7
[M+NH4]+ 258.16009 167.3
[M+K]+ 279.08943 158.6
[M+H-H2O]+ 223.12353 147.1
[M+HCOO]- 285.12447 177.5
[M+CH3COO]- 299.14012 166.7
[M+Na-2H]- 261.10094 162.3
[M]+ 240.12572 157.2
[M]- 240.12682 157.2
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.