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3-Cyanomethyl-7-methoxyphthalide
SpectraBase Compound ID Jm1dConAJUA
InChI InChI=1S/C11H9NO3/c1-14-9-4-2-3-7-8(5-6-12)15-11(13)10(7)9/h2-4,8H,5H2,1H3
InChIKey JUNIOCSWUGGTIE-UHFFFAOYSA-N
Mol Weight 203.2 g/mol
Molecular Formula C11H9NO3
Exact Mass 203.058243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dddvq8Dpi55
Name 3-Cyanomethyl-7-methoxyphthalide
Alternate Name(s) 2-(4-Methoxy-3-oxo-1,3-dihydroisobenzofuran-1-yl)acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H9NO3
InChI InChI=1S/C11H9NO3/c1-14-9-4-2-3-7-8(5-6-12)15-11(13)10(7)9/h2-4,8H,5H2,1H3
InChIKey JUNIOCSWUGGTIE-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol201563r
Molecular Weight 203.197 g/mol
SMILES c1(cccc2C(OC(c12)=O)CC#N)OC
SPLASH splash10-03di-5910000000-c4d4b8dcaf0b1dfc1e24
Source of Spectrum A1-13-4153/SMS6-3cc
Wiley ID 1753571