CID 165741759

Tert-butyl 3-amino-4-hydroxyoxane-4-carboxylate

Structural Information

Molecular Formula
C10H19NO4
SMILES
CC(C)(C)OC(=O)C1(CCOCC1N)O
InChI
InChI=1S/C10H19NO4/c1-9(2,3)15-8(12)10(13)4-5-14-6-7(10)11/h7,13H,4-6,11H2,1-3H3
InChIKey
JHXFZPLBYLINHR-UHFFFAOYSA-N
Compound name
tert-butyl 3-amino-4-hydroxyoxane-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

217.13141 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.138686 148.7
[M+Na]+ 240.120628 153.6
[M-H]- 216.124134 150.6
[M+NH4]+ 235.165233 166.7
[M+K]+ 256.094568 154.6
[M+H-H2O]+ 200.128670 144.4
[M+HCOO]- 262.129611 165.0
[M+CH3COO]- 276.145261 185.3
[M+Na-2H]- 238.106076 153.6
[M]+ 217.13086142 146.3
[M]- 217.13195858 146.3
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.