CID 415795

93262-73-8

Structural Information

Molecular Formula
C9H18NO
SMILES
C[N+]1(C2CCC1CC(C2)O)C
InChI
InChI=1S/C9H18NO/c1-10(2)7-3-4-8(10)6-9(11)5-7/h7-9,11H,3-6H2,1-2H3/q+1
InChIKey
RRDNENJAOYUEAK-UHFFFAOYSA-N
Compound name
8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

114
Patents

156.13884 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.14612 133.2
[M+Na]+ 179.12806 140.6
[M-H]- 155.13156 133.7
[M+NH4]+ 174.17266 158.0
[M+K]+ 195.10200 132.8
[M+H-H2O]+ 139.13610 131.7
[M+HCOO]- 201.13704 149.4
[M+CH3COO]- 215.15269 168.6
[M+Na-2H]- 177.11351 140.7
[M]+ 156.13829 128.3
[M]- 156.13939 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

patents stripe