CID 15924116

110971-80-7

Structural Information

Molecular Formula
C6H10N2O2
SMILES
COC(=O)[C@@H]1CCC(=N1)N
InChI
InChI=1S/C6H10N2O2/c1-10-6(9)4-2-3-5(7)8-4/h4H,2-3H2,1H3,(H2,7,8)/t4-/m0/s1
InChIKey
OGZOHFQDEAPFIV-BYPYZUCNSA-N
Compound name
methyl (2S)-5-amino-3,4-dihydro-2H-pyrrole-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

142.07423 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.08151 128.1
[M+Na]+ 165.06345 135.7
[M-H]- 141.06695 130.2
[M+NH4]+ 160.10805 149.6
[M+K]+ 181.03739 135.4
[M+H-H2O]+ 125.07149 122.0
[M+HCOO]- 187.07243 151.7
[M+CH3COO]- 201.08808 173.9
[M+Na-2H]- 163.04890 132.0
[M]+ 142.07368 126.7
[M]- 142.07478 126.7
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.