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]+ 168.174676 142.0
[M+Na]+ 190.156618 144.8
[M-H]- 166.160124 143.2
[M+NH4]+ 185.201223 162.2
[M+K]+ 206.130558 142.0
[M+H-H2O]+ 150.164660 135.2
[M+HCOO]- 212.165601 155.8
[M+CH3COO]- 226.181251 152.2
[M+Na-2H]- 188.142066 146.4
[M]+ 167.16685142 130.9
[M]- 167.16794858 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.