CID 138040639

2243510-33-8

Structural Information

Molecular Formula
C9H15NO3
SMILES
CCOC(=N)[C@@H]1C[C@@H]1C(=O)OCC
InChI
InChI=1S/C9H15NO3/c1-3-12-8(10)6-5-7(6)9(11)13-4-2/h6-7,10H,3-5H2,1-2H3/t6-,7+/m1/s1
InChIKey
DOPURGVTRJWLNM-RQJHMYQMSA-N
Compound name
ethyl (1S,2R)-2-(C-ethoxycarbonimidoyl)cyclopropane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.1052 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.11248 140.5
[M+Na]+ 208.09442 150.4
[M+NH4]+ 203.13902 147.6
[M+K]+ 224.06836 147.9
[M-H]- 184.09792 147.2
[M+Na-2H]- 206.07987 146.0
[M]+ 185.10465 144.5
[M]- 185.10575 144.5
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.