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N-[3-(4-Bromophenyl)prop-2-ynoyl]-6-chloro-4-hydroxy-2-oxo-2H-pyran-3-carboxamide
SpectraBase Compound ID LDXq5BqKn1o
InChI InChI=1S/C15H7BrClNO5/c16-9-4-1-8(2-5-9)3-6-12(20)18-14(21)13-10(19)7-11(17)23-15(13)22/h1-2,4-5,7,19H,(H,18,20,21)
InChIKey QIHWAPVXOJRIGX-UHFFFAOYSA-N
Mol Weight 396.58 g/mol
Molecular Formula C15H7BrClNO5
Exact Mass 394.919613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 68gD6RTKGmC
Name N-[3-(4-Bromophenyl)prop-2-ynoyl]-6-chloro-4-hydroxy-2-oxo-2H-pyran-3-carboxamide
Alternate Name(s) N-(3-(4-bromophenyl)propioloyl)-6-chloro-4-hydroxy-2-oxo-2H-pyran-3-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H7BrClNO5
InChI InChI=1S/C15H7BrClNO5/c16-9-4-1-8(2-5-9)3-6-12(20)18-14(21)13-10(19)7-11(17)23-15(13)22/h1-2,4-5,7,19H,(H,18,20,21)
InChIKey QIHWAPVXOJRIGX-UHFFFAOYSA-N
Molecular Weight 396.580 g/mol
SMILES OC=1C=C(OC(C1C(NC(C#Cc1ccc(cc1)Br)=O)=O)=O)Cl
SPLASH splash10-0a4i-1195000000-cf58b9d14785fd9428fb
Source of Spectrum F4-45-806-5d
Wiley ID 1737035