CID 97327

Qwz83c9ikj

Structural Information

Molecular Formula
C8H15NO2
SMILES
CC1(CN1CCC(=O)OC)C
InChI
InChI=1S/C8H15NO2/c1-8(2)6-9(8)5-4-7(10)11-3/h4-6H2,1-3H3
InChIKey
QYEWVKCDJGEIRT-UHFFFAOYSA-N
Compound name
methyl 3-(2,2-dimethylaziridin-1-yl)propanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.11028 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.11756 138.4
[M+Na]+ 180.09950 148.5
[M-H]- 156.10300 142.2
[M+NH4]+ 175.14410 155.6
[M+K]+ 196.07344 147.7
[M+H-H2O]+ 140.10754 133.2
[M+HCOO]- 202.10848 160.0
[M+CH3COO]- 216.12413 181.6
[M+Na-2H]- 178.08495 144.0
[M]+ 157.10973 144.3
[M]- 157.11083 144.3
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

No patent data available for this compound.