CID 101222643

Tert-butyl (2s)-2-methyl-5-oxopyrrolidine-2-carboxylate

Structural Information

Molecular Formula
C10H17NO3
SMILES
C[C@]1(CCC(=O)N1)C(=O)OC(C)(C)C
InChI
InChI=1S/C10H17NO3/c1-9(2,3)14-8(13)10(4)6-5-7(12)11-10/h5-6H2,1-4H3,(H,11,12)/t10-/m0/s1
InChIKey
VHMVPTHFTIAYBB-JTQLQIEISA-N
Compound name
tert-butyl (2S)-2-methyl-5-oxopyrrolidine-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.12085 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.128126 144.7
[M+Na]+ 222.110068 151.7
[M-H]- 198.113574 145.6
[M+NH4]+ 217.154673 165.9
[M+K]+ 238.084008 150.8
[M+H-H2O]+ 182.118110 140.6
[M+HCOO]- 244.119051 162.5
[M+CH3COO]- 258.134701 180.0
[M+Na-2H]- 220.095516 148.2
[M]+ 199.12030142 143.9
[M]- 199.12139858 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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.