For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Propanedinitrile, [9-(2,3-dihydro-1,3-dioxo-1H-inden-2-yl)-9H-xanthen-9-yl]-
SpectraBase Compound ID GplgGgLs0ti
InChI InChI=1S/C25H14N2O3/c26-13-15(14-27)25(22-23(28)16-7-1-2-8-17(16)24(22)29)18-9-3-5-11-20(18)30-21-12-6-4-10-19(21)25/h1-12,15,22H
InChIKey WFDSULHHAICORW-UHFFFAOYSA-N
Mol Weight 390.4 g/mol
Molecular Formula C25H14N2O3
Exact Mass 390.100442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID DUUoFhm2MJx
Name Propanedinitrile, [9-(2,3-dihydro-1,3-dioxo-1H-inden-2-yl)-9H-xanthen-9-yl]-
CAS Registry Number 87688-46-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H14N2O3
InChI InChI=1S/C25H14N2O3/c26-13-15(14-27)25(22-23(28)16-7-1-2-8-17(16)24(22)29)18-9-3-5-11-20(18)30-21-12-6-4-10-19(21)25/h1-12,15,22H
InChIKey WFDSULHHAICORW-UHFFFAOYSA-N
Molecular Weight 390.398 g/mol
SMILES C1(C2(c3c(cccc3)Oc3c2cccc3)C(C#N)C#N)C(c2ccccc2C1=O)=O
SPLASH splash10-03k9-0009000000-b56177084e4620fc8923
Source of Spectrum F-39-2435-0
Synonyms 2-(9-Dicyanomethyl-9-xanthyl)indane-1,3-dione 2-[9-(1,3-dioxo-2,3-dihydro-1H-inden-2-yl)-9H-xanthen-9-yl]malononitrile
Wiley ID 1365105