CID 145915726

Rac-(7r,8r)-5-oxa-2-azaspiro[3.4]octane-7,8-diol hydrochloride

Structural Information

Molecular Formula
C6H11NO3
SMILES
C1[C@H]([C@H](C2(O1)CNC2)O)O
InChI
InChI=1S/C6H11NO3/c8-4-1-10-6(5(4)9)2-7-3-6/h4-5,7-9H,1-3H2/t4-,5-/m1/s1
InChIKey
BBGDMBJRVFBCIR-RFZPGFLSSA-N
Compound name
(7R,8R)-5-oxa-2-azaspiro[3.4]octane-7,8-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

145.0739 Da
Monoisotopic Mass

-2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.08118 124.4
[M+Na]+ 168.06312 130.0
[M-H]- 144.06662 125.6
[M+NH4]+ 163.10772 138.7
[M+K]+ 184.03706 131.9
[M+H-H2O]+ 128.07116 115.6
[M+HCOO]- 190.07210 139.9
[M+CH3COO]- 204.08775 167.3
[M+Na-2H]- 166.04857 130.2
[M]+ 145.07335 128.3
[M]- 145.07445 128.3
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.