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7-BENZYLOXY-8-IODOCOUMARIN

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

7-BENZYLOXY-8-IODOCOUMARIN
SpectraBase Compound ID AhN5LGgk5xD
InChI InChI=1S/C16H11IO3/c17-15-13(19-10-11-4-2-1-3-5-11)8-6-12-7-9-14(18)20-16(12)15/h1-9H,10H2
InChIKey RVQLEGZQXVEYOA-UHFFFAOYSA-N
Mol Weight 378.17 g/mol
Molecular Formula C16H11IO3
Exact Mass 377.975289 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L8GspGHH7Ot
Name 7-Benzoxy-8-iodo-coumarin
Alternate Name(s) 7-Benzyloxy-8-iodo-chromen-2-one 8-iodanyl-7-phenylmethoxy-chromen-2-one 8-iodo-7-phenylmethoxy-1-benzopyran-2-one 8-iodo-7-phenylmethoxychromen-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11IO3
InChI InChI=1S/C16H11IO3/c17-15-13(19-10-11-4-2-1-3-5-11)8-6-12-7-9-14(18)20-16(12)15/h1-9H,10H2
InChIKey RVQLEGZQXVEYOA-UHFFFAOYSA-N
Molecular Weight 378.165 g/mol
SMILES c12c(c(OCc3ccccc3)ccc2C=CC(O1)=O)I
SPLASH splash10-0006-9000000000-6221a719f7d1799e8508
Source of Spectrum KC-0-3254-9
Wiley ID 782636