CID 82391469

2102853-20-1

Structural Information

Molecular Formula
C12H22N2O2
SMILES
CC(C)(C)OC(=O)N1CC[C@H]([C@@H]1C2CC2)N
InChI
InChI=1S/C12H22N2O2/c1-12(2,3)16-11(15)14-7-6-9(13)10(14)8-4-5-8/h8-10H,4-7,13H2,1-3H3/t9-,10+/m1/s1
InChIKey
MIFWZSDBAYSRDA-ZJUUUORDSA-N
Compound name
tert-butyl (2S,3R)-3-amino-2-cyclopropylpyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.16812 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.17540 153.9
[M+Na]+ 249.15734 161.4
[M-H]- 225.16084 159.4
[M+NH4]+ 244.20194 167.7
[M+K]+ 265.13128 158.4
[M+H-H2O]+ 209.16538 147.8
[M+HCOO]- 271.16632 172.8
[M+CH3COO]- 285.18197 194.0
[M+Na-2H]- 247.14279 154.6
[M]+ 226.16757 154.5
[M]- 226.16867 154.5
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.