CID 9899129

Tert-butyl 4-hydroxy-2-oxopyrrolidine-1-carboxylate

Structural Information

Molecular Formula
C9H15NO4
SMILES
CC(C)(C)OC(=O)N1CC(CC1=O)O
InChI
InChI=1S/C9H15NO4/c1-9(2,3)14-8(13)10-5-6(11)4-7(10)12/h6,11H,4-5H2,1-3H3
InChIKey
GUVYWSACSIYEDN-UHFFFAOYSA-N
Compound name
tert-butyl 4-hydroxy-2-oxopyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

201.10011 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.10739 143.7
[M+Na]+ 224.08933 151.1
[M-H]- 200.09283 144.8
[M+NH4]+ 219.13393 163.1
[M+K]+ 240.06327 150.7
[M+H-H2O]+ 184.09737 138.9
[M+HCOO]- 246.09831 162.0
[M+CH3COO]- 260.11396 180.1
[M+Na-2H]- 222.07478 145.8
[M]+ 201.09956 143.9
[M]- 201.10066 143.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe