CID 138394788

Spirotetramat-di-hydroxy

Structural Information

Molecular Formula
C18H25NO4
SMILES
CC1=CC(=C(C=C1)C)C2(C(C3(CCC(CC3)OC)NC2=O)O)O
InChI
InChI=1S/C18H25NO4/c1-11-4-5-12(2)14(10-11)18(22)15(20)17(19-16(18)21)8-6-13(23-3)7-9-17/h4-5,10,13,15,20,22H,6-9H2,1-3H3,(H,19,21)
InChIKey
UQUUEPYRZJQJNA-UHFFFAOYSA-N
Compound name
3-(2,5-dimethylphenyl)-3,4-dihydroxy-8-methoxy-1-azaspiro[4.5]decan-2-one
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

0
Patents

319.17834 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.185616 175.4
[M+Na]+ 342.167558 182.4
[M-H]- 318.171064 179.1
[M+NH4]+ 337.212163 192.8
[M+K]+ 358.141498 177.5
[M+H-H2O]+ 302.175600 169.4
[M+HCOO]- 364.176541 188.4
[M+CH3COO]- 378.192191 200.1
[M+Na-2H]- 340.153006 174.9
[M]+ 319.17779142 170.7
[M]- 319.17888858 170.7
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.