CID 145909665

2377004-59-4

Structural Information

Molecular Formula
C9H17NO3
SMILES
C1COCCC12C[C@@H]([C@@H](CN2)O)O
InChI
InChI=1S/C9H17NO3/c11-7-5-9(10-6-8(7)12)1-3-13-4-2-9/h7-8,10-12H,1-6H2/t7-,8+/m0/s1
InChIKey
CPRATXICNQHASD-JGVFFNPUSA-N
Compound name
(3R,4S)-9-oxa-1-azaspiro[5.5]undecane-3,4-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.12085 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.12813 142.7
[M+Na]+ 210.11007 151.7
[M+NH4]+ 205.15467 151.6
[M+K]+ 226.08401 145.7
[M-H]- 186.11357 144.7
[M+Na-2H]- 208.09552 146.7
[M]+ 187.12030 144.4
[M]- 187.12140 144.4
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.