CID 83681689

1-methyl-1-azaspiro[4.4]nonan-4-one

Structural Information

Molecular Formula
C9H15NO
SMILES
CN1CCC(=O)C12CCCC2
InChI
InChI=1S/C9H15NO/c1-10-7-4-8(11)9(10)5-2-3-6-9/h2-7H2,1H3
InChIKey
LXUGPSVRMXCOQJ-UHFFFAOYSA-N
Compound name
1-methyl-1-azaspiro[4.4]nonan-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

153.11537 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.12265 134.9
[M+Na]+ 176.10459 142.1
[M-H]- 152.10809 139.1
[M+NH4]+ 171.14919 160.4
[M+K]+ 192.07853 140.6
[M+H-H2O]+ 136.11263 129.4
[M+HCOO]- 198.11357 155.7
[M+CH3COO]- 212.12922 173.6
[M+Na-2H]- 174.09004 137.4
[M]+ 153.11482 130.6
[M]- 153.11592 130.6
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.