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Flucloxacllin-artifact 5

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Flucloxacllin-artifact 5
SpectraBase Compound ID 7dcdVmdpjI8
InChI InChI=1S/C18H15ClFN3O5S/c1-18(2)13(17(26)27)23-15(25)12(16(23)29-18)21-14(24)7-6-28-22-11(7)10-8(19)4-3-5-9(10)20/h3-6,12-13,16H,1-2H3,(H,21,24)(H,26,27)
InChIKey RYHWRDLIJUQPNF-UHFFFAOYSA-N
Mol Weight 439.85 g/mol
Molecular Formula C18H15ClFN3O5S
Exact Mass 439.040498 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HXTS9XsmAEu
Name FLUCLOXACLLIN-ARTIFACT 5
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C18H15ClFN3O5S
InChI InChI=1S/C18H15ClFN3O5S/c1-18(2)13(17(26)27)23-15(25)12(16(23)29-18)21-14(24)7-6-28-22-11(7)10-8(19)4-3-5-9(10)20/h3-6,12-13,16H,1-2H3,(H,21,24)(H,26,27)
InChIKey RYHWRDLIJUQPNF-UHFFFAOYSA-N
Instrument Name GC
Molecular Weight 439.845 g/mol
SMILES N(C1C(N2C(C(O)=O)C(SC12)(C)C)=O)C(=O)c1c(-c2c(Cl)cccc2F)noc1
SPLASH splash10-0006-9810000000-c7f99c44a7e57c9caa3a
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany