CID 165670338

Rac-(2r,6r)-4-[(tert-butoxy)carbonyl]-6-methoxymorpholine-2-carboxylic acid

Structural Information

Molecular Formula
C11H19NO6
SMILES
CC(C)(C)OC(=O)N1C[C@H](O[C@@H](C1)OC)C(=O)O
InChI
InChI=1S/C11H19NO6/c1-11(2,3)18-10(15)12-5-7(9(13)14)17-8(6-12)16-4/h7-8H,5-6H2,1-4H3,(H,13,14)/t7-,8-/m0/s1
InChIKey
UGCHZGRYQLBPFS-YUMQZZPRSA-N
Compound name
(2S,6S)-6-methoxy-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.12125 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.12853 156.5
[M+Na]+ 284.11047 161.8
[M-H]- 260.11397 157.7
[M+NH4]+ 279.15507 170.1
[M+K]+ 300.08441 163.6
[M+H-H2O]+ 244.11851 150.6
[M+HCOO]- 306.11945 170.6
[M+CH3COO]- 320.13510 192.1
[M+Na-2H]- 282.09592 159.0
[M]+ 261.12070 158.4
[M]- 261.12180 158.4
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.