CID 57942

N-isopentil-3-isogranatanina bromidrato [italian]

Structural Information

Molecular Formula
C13H25N
SMILES
CC(C)CCN1CC2CCC(C1)CC2
InChI
InChI=1S/C13H25N/c1-11(2)7-8-14-9-12-3-4-13(10-14)6-5-12/h11-13H,3-10H2,1-2H3
InChIKey
OYBYPNLDBYYMFL-UHFFFAOYSA-N
Compound name
3-(3-methylbutyl)-3-azabicyclo[3.2.2]nonane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.1987 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.20598 153.0
[M+Na]+ 218.18792 159.0
[M-H]- 194.19142 152.9
[M+NH4]+ 213.23252 173.0
[M+K]+ 234.16186 155.7
[M+H-H2O]+ 178.19596 153.1
[M+HCOO]- 240.19690 162.2
[M+CH3COO]- 254.21255 161.9
[M+Na-2H]- 216.17337 160.4
[M]+ 195.19815 151.2
[M]- 195.19925 151.2
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.