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2-[p-(methylthio)phenyl]-3-nitro-2H-1-benzopyran

View entire compound with spectra: 2 NMR, and 1 FTIR

2-[p-(methylthio)phenyl]-3-nitro-2H-1-benzopyran
SpectraBase Compound ID FyrkSGTWaRL
InChI InChI=1S/C16H13NO3S/c1-21-13-8-6-11(7-9-13)16-14(17(18)19)10-12-4-2-3-5-15(12)20-16/h2-10,16H,1H3
InChIKey SFWMPLLFBKYUCF-UHFFFAOYSA-N
Mol Weight 299.34 g/mol
Molecular Formula C16H13NO3S
Exact Mass 299.061614 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LQIthIekyUz
Name 2-[p-(METHYLTHIO)PHENYL]-3-NITRO-2H-1-BENZOPYRAN
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13NO3S
InChI InChI=1S/C16H13NO3S/c1-21-13-8-6-11(7-9-13)16-14(17(18)19)10-12-4-2-3-5-15(12)20-16/h2-10,16H,1H3
InChIKey SFWMPLLFBKYUCF-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 106C
Molecular Weight 299.35
Solvent CDCl3; Reference=TMS; Temperature 297K