CID 177798876

3-methyl-7-oxa-1-azaspiro[3.5]nonan-2-one

Structural Information

Molecular Formula
C8H13NO2
SMILES
CC1C(=O)NC12CCOCC2
InChI
InChI=1S/C8H13NO2/c1-6-7(10)9-8(6)2-4-11-5-3-8/h6H,2-5H2,1H3,(H,9,10)
InChIKey
JYSZVTMTXGJMCT-UHFFFAOYSA-N
Compound name
3-methyl-7-oxa-1-azaspiro[3.5]nonan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.09464 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.101916 127.6
[M+Na]+ 178.083858 133.1
[M-H]- 154.087364 131.0
[M+NH4]+ 173.128463 141.2
[M+K]+ 194.057798 135.6
[M+H-H2O]+ 138.091900 117.6
[M+HCOO]- 200.092841 143.5
[M+CH3COO]- 214.108491 175.4
[M+Na-2H]- 176.069306 134.7
[M]+ 155.09409142 131.7
[M]- 155.09518858 131.7
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.