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Ethiofencarb, N-heptafluorobutyryl-

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Ethiofencarb, N-heptafluorobutyryl-
SpectraBase Compound ID 8Db0rabqnNQ
InChI InChI=1S/C15H14F7NO3S/c1-3-27-8-9-6-4-5-7-10(9)26-12(25)23(2)11(24)13(16,17)14(18,19)15(20,21)22/h4-7H,3,8H2,1-2H3
InChIKey PRXOJWHVUXEJAG-UHFFFAOYSA-N
Mol Weight 421.33 g/mol
Molecular Formula C15H14F7NO3S
Exact Mass 421.058262 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID ITiPGsZ0ZkR
Name Ethiofencarb, N-heptafluorobutyryl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 421.058261627 u
Formula C15H14F7NO3S
InChI InChI=1S/C15H14F7NO3S/c1-3-27-8-9-6-4-5-7-10(9)26-12(25)23(2)11(24)13(16,17)14(18,19)15(20,21)22/h4-7H,3,8H2,1-2H3
InChIKey PRXOJWHVUXEJAG-UHFFFAOYSA-N
Molecular Weight 421.330 g/mol
SMILES C(SCC)C1=C(OC(N(C)C(=O)C(C(C(F)(F)F)(F)F)(F)F)=O)C=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.934424