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4-(4-Cyanophenyl)-2-(1,3-dioxoindan-2-ylidene)-1,3-oxathiolane
SpectraBase Compound ID 4a0L7xzI1NL
InChI InChI=1S/C19H11NO3S/c20-9-11-5-7-12(8-6-11)15-10-23-19(24-15)16-17(21)13-3-1-2-4-14(13)18(16)22/h1-8,15H,10H2
InChIKey IMYLSZVWGUZWES-UHFFFAOYSA-N
Mol Weight 333.36 g/mol
Molecular Formula C19H11NO3S
Exact Mass 333.045964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3eymzzHiuJP
Name 4-(4-Cyanophenyl)-2-(1,3-dioxoindan-2-ylidene)-1,3-oxathiolane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H11NO3S
InChI InChI=1S/C19H11NO3S/c20-9-11-5-7-12(8-6-11)15-10-23-19(24-15)16-17(21)13-3-1-2-4-14(13)18(16)22/h1-8,15H,10H2
InChIKey IMYLSZVWGUZWES-UHFFFAOYSA-N
Molecular Weight 333.361 g/mol
SMILES C1(OCC(S1)c1ccc(cc1)C#N)=C1C(c2c(C1=O)cccc2)=O
SPLASH splash10-03di-0903000000-f3817c6e268da994f293
Source of Spectrum E1-44-659-9
Synonyms 4-[2-(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)-1,3-oxathiolan-4-yl]benzonitrile
Wiley ID 1553399