CID 132389728

Tert-butyl 3-oxomorpholine-2-carboxylate

Structural Information

Molecular Formula
C9H15NO4
SMILES
CC(C)(C)OC(=O)C1C(=O)NCCO1
InChI
InChI=1S/C9H15NO4/c1-9(2,3)14-8(12)6-7(11)10-4-5-13-6/h6H,4-5H2,1-3H3,(H,10,11)
InChIKey
UAZHPDWHDLDSKT-UHFFFAOYSA-N
Compound name
tert-butyl 3-oxomorpholine-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.10011 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.10739 143.5
[M+Na]+ 224.08933 149.2
[M-H]- 200.09283 144.6
[M+NH4]+ 219.13393 159.3
[M+K]+ 240.06327 149.6
[M+H-H2O]+ 184.09737 137.8
[M+HCOO]- 246.09831 158.8
[M+CH3COO]- 260.11396 180.0
[M+Na-2H]- 222.07478 148.3
[M]+ 201.09956 141.9
[M]- 201.10066 141.9
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.