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

84
Patents

156.13884 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.146116 133.2
[M+Na]+ 179.128058 140.6
[M-H]- 155.131564 133.7
[M+NH4]+ 174.172663 158.0
[M+K]+ 195.101998 132.8
[M+H-H2O]+ 139.136100 131.7
[M+HCOO]- 201.137041 149.4
[M+CH3COO]- 215.152691 168.6
[M+Na-2H]- 177.113506 140.7
[M]+ 156.13829142 128.3
[M]- 156.13938858 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