CID 377655

Nsc659236

Structural Information

Molecular Formula
C9H16N2O2
SMILES
CCOC(=O)CC(N1CC1)N2CC2
InChI
InChI=1S/C9H16N2O2/c1-2-13-9(12)7-8(10-3-4-10)11-5-6-11/h8H,2-7H2,1H3
InChIKey
ICZOIUCOVUFDLN-UHFFFAOYSA-N
Compound name
ethyl 3,3-bis(aziridin-1-yl)propanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

184.12119 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.12847 162.3
[M+Na]+ 207.11041 169.1
[M-H]- 183.11391 166.5
[M+NH4]+ 202.15501 168.3
[M+K]+ 223.08435 166.9
[M+H-H2O]+ 167.11845 154.5
[M+HCOO]- 229.11939 179.4
[M+CH3COO]- 243.13504 195.0
[M+Na-2H]- 205.09586 163.1
[M]+ 184.12064 166.9
[M]- 184.12174 166.9
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.