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Flocoumafen me
SpectraBase Compound ID JLziQrCfGvC
InChI InChI=1S/C34H27F3O4/c1-39-32-28-8-4-5-9-30(28)41-33(38)31(32)29-19-24(18-23-6-2-3-7-27(23)29)22-12-16-26(17-13-22)40-20-21-10-14-25(15-11-21)34(35,36)37/h2-17,24,29H,18-20H2,1H3
InChIKey DLKZSXGAXLNQLO-UHFFFAOYSA-N
Mol Weight 556.6 g/mol
Molecular Formula C34H27F3O4
Exact Mass 556.186144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GVVratXyltY
Name Flocoumafen ME
Classification Rodenticide
Copyright Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 556.186143834 u
Formula C34H27F3O4
InChI InChI=1S/C34H27F3O4/c1-39-32-28-8-4-5-9-30(28)41-33(38)31(32)29-19-24(18-23-6-2-3-7-27(23)29)22-12-16-26(17-13-22)40-20-21-10-14-25(15-11-21)34(35,36)37/h2-17,24,29H,18-20H2,1H3
InChIKey DLKZSXGAXLNQLO-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 556.581 g/mol
Nominal Mass 556 u
Quality 956
Retention Index 4212
SMILES C1(C2C=3C(CC(C2)C2=CC=C(C=C2)OCC=2C=CC(C(F)(F)F)=CC2)=CC=CC3)=C(C=2C(OC1=O)=CC=CC2)OC
SPLASH splash10-0zfr-0988010000-1bfcae70869c24fd157a
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-methoxy-3-(3-(4-((4-(trifluoromethyl)benzyl)oxy)phenyl)-1,2,3,4-tetrahydronaphthalen-1-yl)-2H-\rchromen-2-one
Technique GC/MS
Wiley ID DD2024_001429