CID 6265

Dimethrin

Structural Information

Molecular Formula
C19H26O2
SMILES
CC1=CC(=C(C=C1)COC(=O)C2C(C2(C)C)C=C(C)C)C
InChI
InChI=1S/C19H26O2/c1-12(2)9-16-17(19(16,5)6)18(20)21-11-15-8-7-13(3)10-14(15)4/h7-10,16-17H,11H2,1-6H3
InChIKey
FHNKBSDJERHDHZ-UHFFFAOYSA-N
Compound name
(2,4-dimethylphenyl)methyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

4
References

6484
Patents

286.19327 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.20055 168.7
[M+Na]+ 309.18249 182.5
[M+NH4]+ 304.22709 178.0
[M+K]+ 325.15643 175.5
[M-H]- 285.18599 178.5
[M+Na-2H]- 307.16794 177.6
[M]+ 286.19272 174.8
[M]- 286.19382 174.8
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

patents stripe