CID 170914887

{6-oxa-3-azabicyclo[3.2.1]octan-7-yl}methanol hydrochloride

Structural Information

Molecular Formula
C7H13NO2
SMILES
C1C2CNCC1OC2CO
InChI
InChI=1S/C7H13NO2/c9-4-7-5-1-6(10-7)3-8-2-5/h5-9H,1-4H2
InChIKey
LBMXCRKJEZSPIW-UHFFFAOYSA-N
Compound name
6-oxa-3-azabicyclo[3.2.1]octan-7-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

143.09464 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.10192 129.2
[M+Na]+ 166.08386 135.2
[M-H]- 142.08736 128.0
[M+NH4]+ 161.12846 150.0
[M+K]+ 182.05780 133.9
[M+H-H2O]+ 126.09190 124.3
[M+HCOO]- 188.09284 144.2
[M+CH3COO]- 202.10849 167.9
[M+Na-2H]- 164.06931 135.3
[M]+ 143.09409 124.8
[M]- 143.09519 124.8
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.