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5-[2-[4-Nitrophenyl]ethenyl]-1,3-benzodioxole
SpectraBase Compound ID GOow04Bbz04
InChI InChI=1S/C15H11NO4/c17-16(18)13-6-3-11(4-7-13)1-2-12-5-8-14-15(9-12)20-10-19-14/h1-9H,10H2/b2-1+
InChIKey YBUXYUGNCKDTFK-OWOJBTEDSA-N
Mol Weight 269.26 g/mol
Molecular Formula C15H11NO4
Exact Mass 269.068808 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2IHLt1cSenS
Name 5-[2-[4-Nitrophenyl]ethenyl]-1,3-benzodioxole
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 269.068807834 u
Formula C15H11NO4
InChI InChI=1S/C15H11NO4/c17-16(18)13-6-3-11(4-7-13)1-2-12-5-8-14-15(9-12)20-10-19-14/h1-9H,10H2/b2-1+
InChIKey YBUXYUGNCKDTFK-OWOJBTEDSA-N
SMILES C1(=CC=C(C=C1)\C=C\C1=CC=C2OCOC2=C1)N(=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.963658