Debug Info

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JAKtdxaxb6n
spectrumID
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JAKtdxaxb6n
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2-(4-Nitrophenyl)sulfinyl-1,4-benzoquinone
SpectraBase Compound ID LTRX6vWAJ4v
InChI InChI=1S/C12H7NO5S/c14-9-3-6-11(15)12(7-9)19(18)10-4-1-8(2-5-10)13(16)17/h1-7H
InChIKey GXRXHFLXHKQCNS-UHFFFAOYSA-N
Mol Weight 277.25 g/mol
Molecular Formula C12H7NO5S
Exact Mass 277.004493 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JAKtdxaxb6n
Name 2-(4-nitrophenyl)sulfinyl-1,4-benzoquinone
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H7NO5S
InChI InChI=1S/C12H7NO5S/c14-9-3-6-11(15)12(7-9)19(18)10-4-1-8(2-5-10)13(16)17/h1-7H
InChIKey GXRXHFLXHKQCNS-UHFFFAOYSA-N
Molecular Weight 277.250 g/mol
SMILES C1(C(=CC(C=C1)=O)S(=O)c1ccc(cc1)N(=O)=O)=O
SPLASH splash10-004i-3390000000-f8062b31c694419571cc
Source of Spectrum J-65-457-1
Synonyms 2-(4-nitrophenyl)sulfinyl-p-benzoquinone 2-(4-nitrophenyl)sulfinylcyclohexa-2,5-diene-1,4-dione
Wiley ID 1532040
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