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]+ 156.10192 127.6
[M+Na]+ 178.08386 133.1
[M-H]- 154.08736 131.0
[M+NH4]+ 173.12846 141.2
[M+K]+ 194.05780 135.6
[M+H-H2O]+ 138.09190 117.6
[M+HCOO]- 200.09284 143.5
[M+CH3COO]- 214.10849 175.4
[M+Na-2H]- 176.06931 134.7
[M]+ 155.09409 131.7
[M]- 155.09519 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.