CID 165588247

2728727-57-7

Structural Information

Molecular Formula
C14H25NO6
SMILES
CC(C)(C)OC(=O)[C@H](CC(=O)CO)NC(=O)OC(C)(C)C
InChI
InChI=1S/C14H25NO6/c1-13(2,3)20-11(18)10(7-9(17)8-16)15-12(19)21-14(4,5)6/h10,16H,7-8H2,1-6H3,(H,15,19)/t10-/m0/s1
InChIKey
BXINFOQPYKXTGB-JTQLQIEISA-N
Compound name
tert-butyl (2S)-5-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.16818 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.17546 169.8
[M+Na]+ 326.15740 173.2
[M+NH4]+ 321.20200 181.5
[M+K]+ 342.13134 174.1
[M-H]- 302.16090 163.7
[M+Na-2H]- 324.14285 167.5
[M]+ 303.16763 167.8
[M]- 303.16873 167.8
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.