CID 658523

15285-58-2

Structural Information

Molecular Formula
C8H16NO
SMILES
C1CC[N+]2(CC1)CC(C2)O
InChI
InChI=1S/C8H16NO/c10-8-6-9(7-8)4-2-1-3-5-9/h8,10H,1-7H2/q+1
InChIKey
XEHJOSYPNNEARP-UHFFFAOYSA-N
Compound name
4-azoniaspiro[3.5]nonan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

54
Patents

142.12318 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.13046 125.3
[M+Na]+ 165.11240 129.8
[M-H]- 141.11590 128.0
[M+NH4]+ 160.15700 140.6
[M+K]+ 181.08634 125.9
[M+H-H2O]+ 125.12044 118.0
[M+HCOO]- 187.12138 141.5
[M+CH3COO]- 201.13703 166.9
[M+Na-2H]- 163.09785 134.4
[M]+ 142.12263 126.1
[M]- 142.12373 126.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe