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2,3-Dihydroxy-5-(phenylmethyl)cyclohexa-2,5-diene-1,4-dione
SpectraBase Compound ID C6fXofGyzaT
InChI InChI=1S/C13H10O4/c14-10-7-9(11(15)13(17)12(10)16)6-8-4-2-1-3-5-8/h1-5,7,16-17H,6H2
InChIKey CNYIXAKXAIBVPV-UHFFFAOYSA-N
Mol Weight 230.22 g/mol
Molecular Formula C13H10O4
Exact Mass 230.057909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BHV1EJ2VKC5
Name 2,3-Dihydroxy-5-(phenylmethyl)cyclohexa-2,5-diene-1,4-dione
Alternate Name(s) 5-Benzyl-2,3-dihydroxybenzo-1,4-quinone
CAS Registry Number 124175-79-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10O4
InChI InChI=1S/C13H10O4/c14-10-7-9(11(15)13(17)12(10)16)6-8-4-2-1-3-5-8/h1-5,7,16-17H,6H2
InChIKey CNYIXAKXAIBVPV-UHFFFAOYSA-N
Molecular Weight 230.219 g/mol
SMILES OC1=C(C(C(=CC1=O)Cc1ccccc1)=O)O
SPLASH splash10-014l-6900000000-dd2a7be8c48641746330
Source of Spectrum J-55-1181-13
Wiley ID 1231765