CID 67223196

Tert-butyl (2r,4r)-4-hydroxy-2-(methoxymethyl)pyrrolidine-1-carboxylate

Structural Information

Molecular Formula
C11H21NO4
SMILES
CC(C)(C)OC(=O)N1C[C@@H](C[C@@H]1COC)O
InChI
InChI=1S/C11H21NO4/c1-11(2,3)16-10(14)12-6-9(13)5-8(12)7-15-4/h8-9,13H,5-7H2,1-4H3/t8-,9-/m1/s1
InChIKey
FGGZZBDJYMUXDT-RKDXNWHRSA-N
Compound name
tert-butyl (2R,4R)-4-hydroxy-2-(methoxymethyl)pyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

53
Patents

231.14706 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.154336 154.3
[M+Na]+ 254.136278 160.6
[M-H]- 230.139784 155.1
[M+NH4]+ 249.180883 172.6
[M+K]+ 270.110218 160.3
[M+H-H2O]+ 214.144320 149.0
[M+HCOO]- 276.145261 171.8
[M+CH3COO]- 290.160911 187.0
[M+Na-2H]- 252.121726 155.3
[M]+ 231.14651142 155.9
[M]- 231.14760858 155.9
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