CID 10889311

Trans-3-(boc-amino)-4-methoxypyrrolidine

Structural Information

Molecular Formula
C10H20N2O3
SMILES
CC(C)(C)OC(=O)N[C@H]1CNC[C@@H]1OC
InChI
InChI=1S/C10H20N2O3/c1-10(2,3)15-9(13)12-7-5-11-6-8(7)14-4/h7-8,11H,5-6H2,1-4H3,(H,12,13)/t7-,8-/m0/s1
InChIKey
PIGDOXPNNMFBNA-YUMQZZPRSA-N
Compound name
tert-butyl N-[(3S,4S)-4-methoxypyrrolidin-3-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

148
Patents

216.1474 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.15468 150.5
[M+Na]+ 239.13662 156.6
[M+NH4]+ 234.18122 156.0
[M+K]+ 255.11056 155.7
[M-H]- 215.14012 148.7
[M+Na-2H]- 237.12207 151.7
[M]+ 216.14685 150.2
[M]- 216.14795 150.2
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