CID 84690601

Tert-butyl 2-(1-aminocyclopropyl)pyrrolidine-1-carboxylate

Structural Information

Molecular Formula
C12H22N2O2
SMILES
CC(C)(C)OC(=O)N1CCCC1C2(CC2)N
InChI
InChI=1S/C12H22N2O2/c1-11(2,3)16-10(15)14-8-4-5-9(14)12(13)6-7-12/h9H,4-8,13H2,1-3H3
InChIKey
MOCKQDBHBGTJRW-UHFFFAOYSA-N
Compound name
tert-butyl 2-(1-aminocyclopropyl)pyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

226.16812 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.17540 154.1
[M+Na]+ 249.15734 161.4
[M-H]- 225.16084 159.5
[M+NH4]+ 244.20194 169.4
[M+K]+ 265.13128 159.4
[M+H-H2O]+ 209.16538 148.9
[M+HCOO]- 271.16632 172.6
[M+CH3COO]- 285.18197 192.4
[M+Na-2H]- 247.14279 156.6
[M]+ 226.16757 154.7
[M]- 226.16867 154.7
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