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(Z)-2-[{Z)-3-{2-Hydroxyethylidene)isobenzofuran-1(3H)-ylidene]acetonitrile
SpectraBase Compound ID AgX0zSM102t
InChI InChI=1S/C12H9NO2/c13-7-5-11-9-3-1-2-4-10(9)12(15-11)6-8-14/h1-6,14H,8H2/b11-5-,12-6-
InChIKey VTBFHBJDOFBVTB-CBIKUMSCSA-N
Mol Weight 199.21 g/mol
Molecular Formula C12H9NO2
Exact Mass 199.063329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ifqq3j2LqR
Name (Z)-2-[{Z)-3-{2-Hydroxyethylidene)isobenzofuran-1(3H)-ylidene]acetonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C12H9NO2
InChI InChI=1S/C12H9NO2/c13-7-5-11-9-3-1-2-4-10(9)12(15-11)6-8-14/h1-6,14H,8H2/b11-5-,12-6-
InChIKey VTBFHBJDOFBVTB-CBIKUMSCSA-N
Molecular Weight 199.209 g/mol
SMILES OC\C=C\1O\C(c2c1cccc2)=C\C#N
SPLASH splash10-00di-0900000000-6e42268384ce35dec241
Source of Spectrum F4-40-1097-2l
Wiley ID 1670481