CID 138987519

Rac-(7r,8s)-5-azaspiro[2.6]nonane-7,8-diol hydrochloride

Structural Information

Molecular Formula
C8H15NO2
SMILES
C1CC12C[C@@H]([C@@H](CNC2)O)O
InChI
InChI=1S/C8H15NO2/c10-6-3-8(1-2-8)5-9-4-7(6)11/h6-7,9-11H,1-5H2/t6-,7+/m0/s1
InChIKey
FGUMRIICVACITC-NKWVEPMBSA-N
Compound name
(7R,8S)-5-azaspiro[2.6]nonane-7,8-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.11028 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.11756 128.4
[M+Na]+ 180.09950 133.9
[M-H]- 156.10300 130.6
[M+NH4]+ 175.14410 142.2
[M+K]+ 196.07344 134.9
[M+H-H2O]+ 140.10754 123.3
[M+HCOO]- 202.10848 143.2
[M+CH3COO]- 216.12413 174.3
[M+Na-2H]- 178.08495 134.0
[M]+ 157.10973 121.6
[M]- 157.11083 121.6
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.