CID 145915613

1683529-07-8

Structural Information

Molecular Formula
C9H15NO4
SMILES
CC(C)(C)OC(=O)N1CCC(=O)CO1
InChI
InChI=1S/C9H15NO4/c1-9(2,3)14-8(12)10-5-4-7(11)6-13-10/h4-6H2,1-3H3
InChIKey
BGLMAZXZHLLELH-UHFFFAOYSA-N
Compound name
tert-butyl 5-oxooxazinane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.10011 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.10739 142.7
[M+Na]+ 224.08933 148.9
[M-H]- 200.09283 145.2
[M+NH4]+ 219.13393 159.3
[M+K]+ 240.06327 150.3
[M+H-H2O]+ 184.09737 136.8
[M+HCOO]- 246.09831 159.5
[M+CH3COO]- 260.11396 181.9
[M+Na-2H]- 222.07478 148.1
[M]+ 201.09956 143.0
[M]- 201.10066 143.0
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.