CID 59646

N-allil-3-isogranatanina bromidrato [italian]

Structural Information

Molecular Formula
C11H19N
SMILES
C=CCN1CC2CCCC(C2)C1
InChI
InChI=1S/C11H19N/c1-2-6-12-8-10-4-3-5-11(7-10)9-12/h2,10-11H,1,3-9H2
InChIKey
DSZZMXSVRRXWCV-UHFFFAOYSA-N
Compound name
3-prop-2-enyl-3-azabicyclo[3.3.1]nonane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

165.15175 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.159026 138.8
[M+Na]+ 188.140968 143.1
[M-H]- 164.144474 138.9
[M+NH4]+ 183.185573 159.5
[M+K]+ 204.114908 140.3
[M+H-H2O]+ 148.149010 132.4
[M+HCOO]- 210.149951 154.0
[M+CH3COO]- 224.165601 180.8
[M+Na-2H]- 186.126416 144.3
[M]+ 165.15120142 133.0
[M]- 165.15229858 133.0
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