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2(5H)-Furanone, 5,5'-(1,4-butanediyldinitrilo)bis-

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

2(5H)-Furanone, 5,5'-(1,4-butanediyldinitrilo)bis-
SpectraBase Compound ID GaJk0bLUW21
InChI InChI=1S/C12H12N2O4/c15-11-5-3-9(17-11)13-7-1-2-8-14-10-4-6-12(16)18-10/h3-6H,1-2,7-8H2/b13-9+,14-10+
InChIKey RNWWJRJCEONHDO-UTLPMFLDSA-N
Mol Weight 248.24 g/mol
Molecular Formula C12H12N2O4
Exact Mass 248.079707 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LHoZ0S6IMpr
Name 2(5H)-Furanone, 5,5'-(1,4-butanediyldinitrilo)bis-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 248.079706870 u
Formula C12H12N2O4
InChI InChI=1S/C12H12N2O4/c15-11-5-3-9(17-11)13-7-1-2-8-14-10-4-6-12(16)18-10/h3-6H,1-2,7-8H2/b13-9+,14-10+
InChIKey RNWWJRJCEONHDO-UTLPMFLDSA-N
Molecular Weight 248.238 g/mol
SMILES C(\N=C/1OC(=O)C=C1)CCC\N=C/1OC(=O)C=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.966761