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

2
Patents

142.07423 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.081506 128.1
[M+Na]+ 165.063448 135.7
[M-H]- 141.066954 130.2
[M+NH4]+ 160.108053 149.6
[M+K]+ 181.037388 135.4
[M+H-H2O]+ 125.071490 122.0
[M+HCOO]- 187.072431 151.7
[M+CH3COO]- 201.088081 173.9
[M+Na-2H]- 163.048896 132.0
[M]+ 142.07368142 126.7
[M]- 142.07477858 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

patents stripe