CID 129285162

5-methyl-5,8-diazaspiro[3.5]nonan-6-one

Structural Information

Molecular Formula
C8H14N2O
SMILES
CN1C(=O)CNCC12CCC2
InChI
InChI=1S/C8H14N2O/c1-10-7(11)5-9-6-8(10)3-2-4-8/h9H,2-6H2,1H3
InChIKey
KDNVMEIIEHBQAZ-UHFFFAOYSA-N
Compound name
5-methyl-5,8-diazaspiro[3.5]nonan-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

154.11061 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.117886 132.4
[M+Na]+ 177.099828 138.1
[M-H]- 153.103334 133.6
[M+NH4]+ 172.144433 146.0
[M+K]+ 193.073768 138.9
[M+H-H2O]+ 137.107870 121.4
[M+HCOO]- 199.108811 147.7
[M+CH3COO]- 213.124461 176.1
[M+Na-2H]- 175.085276 138.2
[M]+ 154.11006142 134.9
[M]- 154.11115858 134.9
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

patents stripe