CID 10900332

Tert-butyl n-[(3r,4s)-4-cyclopropylpyrrolidin-3-yl]carbamate

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

226.16812 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.17540 154.7
[M+Na]+ 249.15734 163.0
[M+NH4]+ 244.20194 161.8
[M+K]+ 265.13128 162.3
[M-H]- 225.16084 161.9
[M+Na-2H]- 247.14279 159.9
[M]+ 226.16757 158.6
[M]- 226.16867 158.6
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