CID 84650232

2-(aminomethyl)bicyclo[2.2.2]octan-2-ol hydrochloride

Structural Information

Molecular Formula
C9H17NO
SMILES
C1CC2CCC1CC2(CN)O
InChI
InChI=1S/C9H17NO/c10-6-9(11)5-7-1-3-8(9)4-2-7/h7-8,11H,1-6,10H2
InChIKey
VZMVBYGOJBVOPT-UHFFFAOYSA-N
Compound name
2-(aminomethyl)bicyclo[2.2.2]octan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.13101 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.138286 135.1
[M+Na]+ 178.120228 139.3
[M-H]- 154.123734 130.2
[M+NH4]+ 173.164833 161.4
[M+K]+ 194.094168 136.6
[M+H-H2O]+ 138.128270 131.3
[M+HCOO]- 200.129211 146.2
[M+CH3COO]- 214.144861 145.5
[M+Na-2H]- 176.105676 146.3
[M]+ 155.13046142 132.6
[M]- 155.13155858 132.6
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.