CID 3040068

3-(2-imidazolinylmethyl)quinuclidine

Structural Information

Molecular Formula
C11H19N3
SMILES
C1CN2CCC1C(C2)CC3=NCCN3
InChI
InChI=1S/C11H19N3/c1-5-14-6-2-9(1)10(8-14)7-11-12-3-4-13-11/h9-10H,1-8H2,(H,12,13)
InChIKey
WWIGDDMIOIIUGD-UHFFFAOYSA-N
Compound name
3-(4,5-dihydro-1H-imidazol-2-ylmethyl)-1-azabicyclo[2.2.2]octane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.1579 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.165176 141.6
[M+Na]+ 216.147118 144.9
[M-H]- 192.150624 135.6
[M+NH4]+ 211.191723 162.3
[M+K]+ 232.121058 141.3
[M+H-H2O]+ 176.155160 134.0
[M+HCOO]- 238.156101 148.9
[M+CH3COO]- 252.171751 150.3
[M+Na-2H]- 214.132566 149.6
[M]+ 193.15735142 138.2
[M]- 193.15844858 138.2
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.