CID 425113

Nsc170543

Structural Information

Molecular Formula
C10H20N2O
SMILES
CN(C)CC1C(C2CCN1CC2)O
InChI
InChI=1S/C10H20N2O/c1-11(2)7-9-10(13)8-3-5-12(9)6-4-8/h8-10,13H,3-7H2,1-2H3
InChIKey
QCSQYKDYQANCJV-UHFFFAOYSA-N
Compound name
2-[(dimethylamino)methyl]-1-azabicyclo[2.2.2]octan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

184.15756 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.164836 142.8
[M+Na]+ 207.146778 146.2
[M-H]- 183.150284 138.0
[M+NH4]+ 202.191383 165.7
[M+K]+ 223.120718 145.2
[M+H-H2O]+ 167.154820 137.7
[M+HCOO]- 229.155761 153.4
[M+CH3COO]- 243.171411 152.7
[M+Na-2H]- 205.132226 152.1
[M]+ 184.15701142 143.2
[M]- 184.15810858 143.2
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.