CID 77452832

1544613-82-2

Structural Information

Molecular Formula
C11H22N2O3
SMILES
CC(C)(C)OC(=O)N1CC(CC1CN)OC
InChI
InChI=1S/C11H22N2O3/c1-11(2,3)16-10(14)13-7-9(15-4)5-8(13)6-12/h8-9H,5-7,12H2,1-4H3
InChIKey
WEDVNHOTDTUUJA-UHFFFAOYSA-N
Compound name
tert-butyl 2-(aminomethyl)-4-methoxypyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

230.16304 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.17032 154.3
[M+Na]+ 253.15226 160.9
[M+NH4]+ 248.19686 159.9
[M+K]+ 269.12620 159.9
[M-H]- 229.15576 152.9
[M+Na-2H]- 251.13771 155.2
[M]+ 230.16249 154.3
[M]- 230.16359 154.3
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.