CID 58006925

960289-56-9

Structural Information

Molecular Formula
C11H22N2O3
SMILES
CC(C)(C)OC(=O)N1C[C@H]([C@@H](C1)O)N(C)C
InChI
InChI=1S/C11H22N2O3/c1-11(2,3)16-10(15)13-6-8(12(4)5)9(14)7-13/h8-9,14H,6-7H2,1-5H3/t8-,9-/m1/s1
InChIKey
VYJCQLFIOYWZQH-RKDXNWHRSA-N
Compound name
tert-butyl (3R,4R)-3-(dimethylamino)-4-hydroxypyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

66
Patents

230.16304 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.170316 154.6
[M+Na]+ 253.152258 160.3
[M-H]- 229.155764 156.9
[M+NH4]+ 248.196863 173.3
[M+K]+ 269.126198 160.9
[M+H-H2O]+ 213.160300 149.0
[M+HCOO]- 275.161241 173.4
[M+CH3COO]- 289.176891 193.3
[M+Na-2H]- 251.137706 155.3
[M]+ 230.16249142 155.3
[M]- 230.16358858 155.3
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

patents stripe