CID 75420881

5-methyl-2-azaspiro[5.5]undecane

Structural Information

Molecular Formula
C11H21N
SMILES
CC1CCNCC12CCCCC2
InChI
InChI=1S/C11H21N/c1-10-5-8-12-9-11(10)6-3-2-4-7-11/h10,12H,2-9H2,1H3
InChIKey
TVLSMDVQXJUDGZ-UHFFFAOYSA-N
Compound name
5-methyl-2-azaspiro[5.5]undecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.1674 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.17468 142.0
[M+Na]+ 190.15662 144.8
[M-H]- 166.16012 143.2
[M+NH4]+ 185.20122 162.2
[M+K]+ 206.13056 142.0
[M+H-H2O]+ 150.16466 135.2
[M+HCOO]- 212.16560 155.8
[M+CH3COO]- 226.18125 152.2
[M+Na-2H]- 188.14207 146.4
[M]+ 167.16685 130.9
[M]- 167.16795 130.9
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.