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1-nitro-4-((phenylethynyl)sulfonyl)benzene
SpectraBase Compound ID GqyfP7URocD
InChI InChI=1S/C14H9NO4S/c16-15(17)13-6-8-14(9-7-13)20(18,19)11-10-12-4-2-1-3-5-12/h1-9H
InChIKey KFSFCKRVWQXMGC-UHFFFAOYSA-N
Mol Weight 287.29 g/mol
Molecular Formula C14H9NO4S
Exact Mass 287.025229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 64K8ISQbWro
Name 1-nitro-4-((phenylethynyl)sulfonyl)benzene
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H9NO4S
InChI InChI=1S/C14H9NO4S/c16-15(17)13-6-8-14(9-7-13)20(18,19)11-10-12-4-2-1-3-5-12/h1-9H
InChIKey KFSFCKRVWQXMGC-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 287.289 g/mol
Reported Formula C14H9NO4S
SMILES C(S(c1ccc(cc1)[N+]([O-])=O)(=O)=O)#Cc1ccccc1
SPLASH splash10-000i-9560000000-b9d3dbb1d140b4a0071b
Source of Spectrum CN109456237A
Wiley ID 1872657