CID 67312106

1202067-34-2

Structural Information

Molecular Formula
C10H16N2O4
SMILES
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)OC(=O)N2
InChI
InChI=1S/C10H16N2O4/c1-10(2,3)16-9(14)12-4-6-7(5-12)15-8(13)11-6/h6-7H,4-5H2,1-3H3,(H,11,13)/t6-,7+/m0/s1
InChIKey
XZAVZXYVYKZUTE-NKWVEPMBSA-N
Compound name
tert-butyl (3aS,6aR)-2-oxo-3a,4,6,6a-tetrahydro-3H-pyrrolo[3,4-d][1,3]oxazole-5-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

228.11101 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.11829 150.4
[M+Na]+ 251.10023 156.9
[M+NH4]+ 246.14483 155.6
[M+K]+ 267.07417 159.0
[M-H]- 227.10373 148.4
[M+Na-2H]- 249.08568 149.2
[M]+ 228.11046 150.2
[M]- 228.11156 150.2
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

patents stripe