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Methyl 3-(3-bromobenzylidene)-1,3-dihydroisobenzofuran-1-carboxylate
SpectraBase Compound ID FSdtFZWu0Ax
InChI InChI=1S/C17H13BrO3/c1-20-17(19)16-14-8-3-2-7-13(14)15(21-16)10-11-5-4-6-12(18)9-11/h2-10,16H,1H3
InChIKey MFINKJDIUXFGHL-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 B1zikXjMV2X
Name Methyl 3-(3-bromobenzylidene)-1,3-dihydroisobenzofuran-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13BrO3
InChI InChI=1S/C17H13BrO3/c1-20-17(19)16-14-8-3-2-7-13(14)15(21-16)10-11-5-4-6-12(18)9-11/h2-10,16H,1H3
InChIKey MFINKJDIUXFGHL-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 c1cc2c(cc1)C(OC2C(=O)OC)=Cc1cc(ccc1)Br
SPLASH splash10-002r-0491000000-6cb04ce3e584fefe8357
Source of Spectrum BJO-7-635-3c
Wiley ID 1870033