CID 15278321

Fluroxypyr-butometyl

Structural Information

Molecular Formula
C14H19Cl2FN2O4
SMILES
CCCCOCC(C)OC(=O)COC1=NC(=C(C(=C1Cl)N)Cl)F
InChI
InChI=1S/C14H19Cl2FN2O4/c1-3-4-5-21-6-8(2)23-9(20)7-22-14-11(16)12(18)10(15)13(17)19-14/h8H,3-7H2,1-2H3,(H2,18,19)
InChIKey
ZKFARSBUEBZZJT-UHFFFAOYSA-N
Compound name
1-butoxypropan-2-yl 2-(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxyacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1781
Patents

368.0706 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 369.07788 176.7
[M+Na]+ 391.05982 185.4
[M-H]- 367.06332 176.9
[M+NH4]+ 386.10442 189.4
[M+K]+ 407.03376 180.9
[M+H-H2O]+ 351.06786 170.1
[M+HCOO]- 413.06880 187.4
[M+CH3COO]- 427.08445 216.9
[M+Na-2H]- 389.04527 175.1
[M]+ 368.07005 184.5
[M]- 368.07115 184.5
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

patents stripe