CID 75412486

664364-20-9

Structural Information

Molecular Formula
C10H17NO4
SMILES
C[C@H]1[C@H](CC(=O)N1C(=O)OC(C)(C)C)O
InChI
InChI=1S/C10H17NO4/c1-6-7(12)5-8(13)11(6)9(14)15-10(2,3)4/h6-7,12H,5H2,1-4H3/t6-,7-/m0/s1
InChIKey
KISRHDLCFAHVPK-BQBZGAKWSA-N
Compound name
tert-butyl (2S,3S)-3-hydroxy-2-methyl-5-oxopyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

215.11575 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.123026 147.3
[M+Na]+ 238.104968 155.2
[M-H]- 214.108474 148.6
[M+NH4]+ 233.149573 166.4
[M+K]+ 254.078908 154.6
[M+H-H2O]+ 198.113010 142.7
[M+HCOO]- 260.113951 165.2
[M+CH3COO]- 274.129601 184.4
[M+Na-2H]- 236.090416 148.3
[M]+ 215.11520142 148.2
[M]- 215.11629858 148.2
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