CID 139596385

Spirotetramat-oxo-ketohydroxy

Structural Information

Molecular Formula
C17H19NO4
SMILES
CC1=CC(=C(C=C1)C)C2(C(=O)C3(CCC(=O)CC3)NC2=O)O
InChI
InChI=1S/C17H19NO4/c1-10-3-4-11(2)13(9-10)17(22)14(20)16(18-15(17)21)7-5-12(19)6-8-16/h3-4,9,22H,5-8H2,1-2H3,(H,18,21)
InChIKey
OEXHMFFVMPZWOC-UHFFFAOYSA-N
Compound name
3-(2,5-dimethylphenyl)-3-hydroxy-1-azaspiro[4.5]decane-2,4,8-trione
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

0
Patents

301.1314 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.138676 168.0
[M+Na]+ 324.120618 176.5
[M-H]- 300.124124 173.4
[M+NH4]+ 319.165223 186.8
[M+K]+ 340.094558 171.4
[M+H-H2O]+ 284.128660 162.1
[M+HCOO]- 346.129601 183.3
[M+CH3COO]- 360.145251 197.9
[M+Na-2H]- 322.106066 168.5
[M]+ 301.13085142 163.4
[M]- 301.13194858 163.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.