CID 137949334

2227749-31-5

Structural Information

Molecular Formula
C15H25NO6
SMILES
CC(C)(C)OC(=O)[C@@H]1CC[C@@H](N1C(=O)OC(C)(C)C)C(=O)O
InChI
InChI=1S/C15H25NO6/c1-14(2,3)21-12(19)10-8-7-9(11(17)18)16(10)13(20)22-15(4,5)6/h9-10H,7-8H2,1-6H3,(H,17,18)/t9-,10+/m1/s1
InChIKey
IIMFQXVMTWORSM-ZJUUUORDSA-N
Compound name
(2R,5S)-1,5-bis[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

315.16818 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.17546 171.1
[M+Na]+ 338.15740 175.5
[M+NH4]+ 333.20200 173.6
[M+K]+ 354.13134 177.9
[M-H]- 314.16090 165.9
[M+Na-2H]- 336.14285 169.3
[M]+ 315.16763 169.6
[M]- 315.16873 169.6
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.