CID 139597984

Fenpyroximate m-20

Structural Information

Molecular Formula
C24H27N3O5
SMILES
CC(C)(C)OC(=O)C1=CC=C(C=C1)CON=CC2=C(N(N=C2CO)C)OC3=CC=CC=C3
InChI
InChI=1S/C24H27N3O5/c1-24(2,3)32-23(29)18-12-10-17(11-13-18)16-30-25-14-20-21(15-28)26-27(4)22(20)31-19-8-6-5-7-9-19/h5-14,28H,15-16H2,1-4H3
InChIKey
YENVNTMCQDGWDP-UHFFFAOYSA-N
Compound name
tert-butyl 4-[[[3-(hydroxymethyl)-1-methyl-5-phenoxypyrazol-4-yl]methylideneamino]oxymethyl]benzoate
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

0
Patents

437.19507 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 438.20235 206.6
[M+Na]+ 460.18429 212.4
[M-H]- 436.18779 214.2
[M+NH4]+ 455.22889 214.5
[M+K]+ 476.15823 208.9
[M+H-H2O]+ 420.19233 195.9
[M+HCOO]- 482.19327 226.6
[M+CH3COO]- 496.20892 230.6
[M+Na-2H]- 458.16974 207.3
[M]+ 437.19452 213.2
[M]- 437.19562 213.2
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.