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Methyl 3-(3-bromophenyl)-1H-isochromene-1-carboxylate
SpectraBase Compound ID 5ojUH3BWrQ3
InChI InChI=1S/C17H13BrO3/c1-20-17(19)16-14-8-3-2-5-11(14)10-15(21-16)12-6-4-7-13(18)9-12/h2-10,16H,1H3
InChIKey DFEDYVRQCDBHIS-UHFFFAOYSA-N
Mol Weight 345.19 g/mol
Molecular Formula C17H13BrO3
Exact Mass 344.004807 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 23VpKrX1f6
Name Methyl 3-(3-bromophenyl)-1H-isochromene-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13BrO3
InChI InChI=1S/C17H13BrO3/c1-20-17(19)16-14-8-3-2-5-11(14)10-15(21-16)12-6-4-7-13(18)9-12/h2-10,16H,1H3
InChIKey DFEDYVRQCDBHIS-UHFFFAOYSA-N
Instrument Name VG ZAB-HS
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.7.74
Molecular Weight 345.192 g/mol
Reported Formula C17H13BrO3
SMILES c1ccc2C=C(c3cccc(c3)Br)OC(C(OC)=O)c2c1
SPLASH splash10-002r-0692000000-57d617495f29629aae42
Source of Spectrum BJO-7-635-2c
Wiley ID 1870027