CID 132314144

2138182-03-1

Structural Information

Molecular Formula
C15H25NO7
SMILES
CC(C)(C)OC(=O)C1(CN(CCO1)C(=O)OC(C)(C)C)C(=O)O
InChI
InChI=1S/C15H25NO7/c1-13(2,3)22-11(19)15(10(17)18)9-16(7-8-21-15)12(20)23-14(4,5)6/h7-9H2,1-6H3,(H,17,18)
InChIKey
DMRMLPTWDPYQOD-UHFFFAOYSA-N
Compound name
2,4-bis[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

331.16312 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 332.17040 171.4
[M+Na]+ 354.15234 175.5
[M-H]- 330.15584 172.3
[M+NH4]+ 349.19694 183.9
[M+K]+ 370.12628 178.2
[M+H-H2O]+ 314.16038 167.0
[M+HCOO]- 376.16132 182.2
[M+CH3COO]- 390.17697 203.9
[M+Na-2H]- 352.13779 175.0
[M]+ 331.16257 174.4
[M]- 331.16367 174.4
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.