CID 27162

1-(p-methoxybenzoyl)aziridine

Structural Information

Molecular Formula
C10H11NO2
SMILES
COC1=CC=C(C=C1)C(=O)N2CC2
InChI
InChI=1S/C10H11NO2/c1-13-9-4-2-8(3-5-9)10(12)11-6-7-11/h2-5H,6-7H2,1H3
InChIKey
HXICBHVTWBDOFR-UHFFFAOYSA-N
Compound name
aziridin-1-yl-(4-methoxyphenyl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.07898 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.08626 140.0
[M+Na]+ 200.06820 154.2
[M+NH4]+ 195.11280 148.7
[M+K]+ 216.04214 149.6
[M-H]- 176.07170 149.3
[M+Na-2H]- 198.05365 149.9
[M]+ 177.07843 145.7
[M]- 177.07953 145.7
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.