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[(1E,3E)-4-nitropenta-1,3-dienyl]sulfanylbenzene
SpectraBase Compound ID wxkK0EmAmr
InChI InChI=1S/C11H11NO2S/c1-10(12(13)14)6-5-9-15-11-7-3-2-4-8-11/h2-9H,1H3/b9-5+,10-6+
InChIKey STMHGRVFELVUGE-NXZHAISVSA-N
Mol Weight 221.27 g/mol
Molecular Formula C11H11NO2S
Exact Mass 221.05105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ORfrb6Lmde
Name [(1E,3E)-4-nitropenta-1,3-dienyl]sulfanylbenzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11NO2S
InChI InChI=1S/C11H11NO2S/c1-10(12(13)14)6-5-9-15-11-7-3-2-4-8-11/h2-9H,1H3/b9-5+,10-6+
InChIKey STMHGRVFELVUGE-NXZHAISVSA-N
Molecular Weight 221.274 g/mol
SMILES c1(S\C=C\C=C/(N(=O)=O)C)ccccc1
SPLASH splash10-001i-9620000000-006e59ae278e4414cd4c
Source of Spectrum KC-0-1908-4
Synonyms [[(1E,3E)-4-nitropenta-1,3-dienyl]thio]benzene
Wiley ID 786295