CID 139026797

Rac-(8r,9s)-6-azaspiro[4.5]decane-8,9-diol hydrochloride

Structural Information

Molecular Formula
C9H17NO2
SMILES
C1CCC2(C1)C[C@@H]([C@@H](CN2)O)O
InChI
InChI=1S/C9H17NO2/c11-7-5-9(3-1-2-4-9)10-6-8(7)12/h7-8,10-12H,1-6H2/t7-,8+/m0/s1
InChIKey
YSULVJBVYBBLJI-JGVFFNPUSA-N
Compound name
(8R,9S)-6-azaspiro[4.5]decane-8,9-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

171.12593 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.133206 140.3
[M+Na]+ 194.115148 145.1
[M-H]- 170.118654 139.8
[M+NH4]+ 189.159753 161.1
[M+K]+ 210.089088 141.8
[M+H-H2O]+ 154.123190 135.0
[M+HCOO]- 216.124131 154.4
[M+CH3COO]- 230.139781 168.8
[M+Na-2H]- 192.100596 143.0
[M]+ 171.12538142 130.5
[M]- 171.12647858 130.5
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.