CID 71306066

Tert-butyl 3-(pyrrolidin-3-yl)azetidine-1-carboxylate

Structural Information

Molecular Formula
C12H22N2O2
SMILES
CC(C)(C)OC(=O)N1CC(C1)C2CCNC2
InChI
InChI=1S/C12H22N2O2/c1-12(2,3)16-11(15)14-7-10(8-14)9-4-5-13-6-9/h9-10,13H,4-8H2,1-3H3
InChIKey
BRSVASFRYDNVEP-UHFFFAOYSA-N
Compound name
tert-butyl 3-pyrrolidin-3-ylazetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
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 156.2
[M+Na]+ 249.15734 159.1
[M+NH4]+ 244.20194 158.3
[M+K]+ 265.13128 159.2
[M-H]- 225.16084 152.6
[M+Na-2H]- 247.14279 155.8
[M]+ 226.16757 154.0
[M]- 226.16867 154.0
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