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]+ 320.18562 175.4
[M+Na]+ 342.16756 182.4
[M-H]- 318.17106 179.1
[M+NH4]+ 337.21216 192.8
[M+K]+ 358.14150 177.5
[M+H-H2O]+ 302.17560 169.4
[M+HCOO]- 364.17654 188.4
[M+CH3COO]- 378.19219 200.1
[M+Na-2H]- 340.15301 174.9
[M]+ 319.17779 170.7
[M]- 319.17889 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.