CID 21838621

Tert-butyl 4-amino-2-(hydroxymethyl)pyrrolidine-1-carboxylate

Structural Information

Molecular Formula
C10H20N2O3
SMILES
CC(C)(C)OC(=O)N1CC(CC1CO)N
InChI
InChI=1S/C10H20N2O3/c1-10(2,3)15-9(14)12-5-7(11)4-8(12)6-13/h7-8,13H,4-6,11H2,1-3H3
InChIKey
OCLZOKUGIXLYJZ-UHFFFAOYSA-N
Compound name
tert-butyl 4-amino-2-(hydroxymethyl)pyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

128
Patents

216.1474 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.15468 150.2
[M+Na]+ 239.13662 156.4
[M+NH4]+ 234.18122 155.6
[M+K]+ 255.11056 156.0
[M-H]- 215.14012 148.3
[M+Na-2H]- 237.12207 150.8
[M]+ 216.14685 150.0
[M]- 216.14795 150.0
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