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]+ 172.13321 140.3
[M+Na]+ 194.11515 145.1
[M-H]- 170.11865 139.8
[M+NH4]+ 189.15975 161.1
[M+K]+ 210.08909 141.8
[M+H-H2O]+ 154.12319 135.0
[M+HCOO]- 216.12413 154.4
[M+CH3COO]- 230.13978 168.8
[M+Na-2H]- 192.10060 143.0
[M]+ 171.12538 130.5
[M]- 171.12648 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.