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Buclosamide PFP
SpectraBase Compound ID 5KCKjB5O0mm
InChI InChI=1S/C14H13ClF5NO3/c1-2-3-6-21-11(22)9-5-4-8(15)7-10(9)24-12(23)13(16,17)14(18,19)20/h4-5,7H,2-3,6H2,1H3,(H,21,22)
InChIKey ZVEBYBSXTUSOTG-UHFFFAOYSA-N
Mol Weight 373.71 g/mol
Molecular Formula C14H13ClF5NO3
Exact Mass 373.050412 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2m25ZAMG6vw
Name Buclosamide PFP
Classification Pharmaceutical drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 373.050411795 u
Formula C14H13ClF5NO3
InChI InChI=1S/C14H13ClF5NO3/c1-2-3-6-21-11(22)9-5-4-8(15)7-10(9)24-12(23)13(16,17)14(18,19)20/h4-5,7H,2-3,6H2,1H3,(H,21,22)
InChIKey ZVEBYBSXTUSOTG-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 373.707 g/mol
Nominal Mass 373 u
Quality 985
Retention Index 1744
SMILES C(C(F)(F)F)(C(OC=1C(C(NCCCC)=O)=CC=C(C1)Cl)=O)(F)F
SPLASH splash10-0udi-3819000000-228da480fa3d344fbce8
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2-(butylcarbamoyl)-5-chlorophenyl 2,2,3,3,3-pentafluoropropanoate
Technique GC/MS
Wiley ID DD2024_011670