CID 82665350

Tert-butyl 3-(morpholin-3-yl)pyrrolidine-1-carboxylate

Structural Information

Molecular Formula
C13H24N2O3
SMILES
CC(C)(C)OC(=O)N1CCC(C1)C2COCCN2
InChI
InChI=1S/C13H24N2O3/c1-13(2,3)18-12(16)15-6-4-10(8-15)11-9-17-7-5-14-11/h10-11,14H,4-9H2,1-3H3
InChIKey
OHACJNCJCRCNSI-UHFFFAOYSA-N
Compound name
tert-butyl 3-morpholin-3-ylpyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.17868 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.185956 163.3
[M+Na]+ 279.167898 166.1
[M-H]- 255.171404 165.1
[M+NH4]+ 274.212503 176.9
[M+K]+ 295.141838 165.5
[M+H-H2O]+ 239.175940 155.8
[M+HCOO]- 301.176881 174.7
[M+CH3COO]- 315.192531 189.4
[M+Na-2H]- 277.153346 163.6
[M]+ 256.17813142 158.0
[M]- 256.17922858 158.0
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

No patent data available for this compound.