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2H-1-benzopyran-3-carboxylic acid, 6-bromo-2-oxo-, 4-acetylphenyl ester
SpectraBase Compound ID 7XSI68BYNBM
InChI InChI=1S/C18H11BrO5/c1-10(20)11-2-5-14(6-3-11)23-17(21)15-9-12-8-13(19)4-7-16(12)24-18(15)22/h2-9H,1H3
InChIKey URJSJFNKBJZFTE-UHFFFAOYSA-N
Mol Weight 387.19 g/mol
Molecular Formula C18H11BrO5
Exact Mass 385.978986 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ISWbJQNFIm3
Name 2H-1-benzopyran-3-carboxylic acid, 6-bromo-2-oxo-, 4-acetylphenyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 385.978986449 u
Formula C18H11BrO5
InChI InChI=1S/C18H11BrO5/c1-10(20)11-2-5-14(6-3-11)23-17(21)15-9-12-8-13(19)4-7-16(12)24-18(15)22/h2-9H,1H3
InChIKey URJSJFNKBJZFTE-UHFFFAOYSA-N
Molecular Weight 387.185 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13716
Solvent DMSO-d6
Source Vendor ID: ZI/10026673; Lab Info: PLU; Lab Number: FCI-479-2231