CID 139026872

5-benzyl-5-azaspiro[3.5]nonan-8-amine

Structural Information

Molecular Formula
C15H22N2
SMILES
C1CC2(C1)CC(CCN2CC3=CC=CC=C3)N
InChI
InChI=1S/C15H22N2/c16-14-7-10-17(15(11-14)8-4-9-15)12-13-5-2-1-3-6-13/h1-3,5-6,14H,4,7-12,16H2
InChIKey
KGFHESRNJAEHDI-UHFFFAOYSA-N
Compound name
5-benzyl-5-azaspiro[3.5]nonan-8-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

230.1783 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.18558 153.0
[M+Na]+ 253.16752 156.6
[M-H]- 229.17102 158.6
[M+NH4]+ 248.21212 164.6
[M+K]+ 269.14146 155.6
[M+H-H2O]+ 213.17556 139.7
[M+HCOO]- 275.17650 170.2
[M+CH3COO]- 289.19215 195.1
[M+Na-2H]- 251.15297 157.4
[M]+ 230.17775 154.3
[M]- 230.17885 154.3
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.