CID 83975

Tetramethrin

Structural Information

Molecular Formula
C19H25NO4
SMILES
CC(=CC1C(C1(C)C)C(=O)OCN2C(=O)C3=C(C2=O)CCCC3)C
InChI
InChI=1S/C19H25NO4/c1-11(2)9-14-15(19(14,3)4)18(23)24-10-20-16(21)12-7-5-6-8-13(12)17(20)22/h9,14-15H,5-8,10H2,1-4H3
InChIKey
CXBMCYHAMVGWJQ-UHFFFAOYSA-N
Compound name
(1,3-dioxo-4,5,6,7-tetrahydroisoindol-2-yl)methyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
9
Annotation Hits

163
References

35243
Patents

331.17834 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 332.18562 180.0
[M+Na]+ 354.16756 188.9
[M-H]- 330.17106 186.5
[M+NH4]+ 349.21216 193.0
[M+K]+ 370.14150 184.1
[M+H-H2O]+ 314.17560 174.8
[M+HCOO]- 376.17654 195.1
[M+CH3COO]- 390.19219 213.9
[M+Na-2H]- 352.15301 177.0
[M]+ 331.17779 184.3
[M]- 331.17889 184.3
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.