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DVAUTFWFMRZFOC-UHFFFAOYSA-N
SpectraBase Compound ID 1r9OkLhyAit
InChI InChI=1S/C12H11NO6/c1-2-3-7(14)4-5(10(17)8(3)15)9(16)6(13)12(19)11(4)18/h14-15,17,19H,2,13H2,1H3
InChIKey DVAUTFWFMRZFOC-UHFFFAOYSA-N
Mol Weight 265.22 g/mol
Molecular Formula C12H11NO6
Exact Mass 265.058637 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E7HYyBAcbOM
Name 3-Amino-7-ethyl-2,5,6,8-tetrahydroxy-1,4-dihydronaphthalene-1,4-dione
Alternate Name(s) 3-Amino-6-ethyl-2,5,7,8-tetrahydroxynaphthalene-1,4-dione(Echinamine B) 3,5,7,8-Tetrahydroxy-2-amino-6-ethyl-naphtho-1,4-quinone 2-amino-6-ethyl-3,5,7,8-tetrahydroxynaphthoquinone 3,5,7,8-Tetrahydroxy-2-amino-6-ethyl-2,3-dihydronaphtho-1,4-quinone Echinamine A
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11NO6
InChI InChI=1S/C12H11NO6/c1-2-3-7(14)4-5(10(17)8(3)15)9(16)6(13)12(19)11(4)18/h14-15,17,19H,2,13H2,1H3
InChIKey DVAUTFWFMRZFOC-UHFFFAOYSA-N
Molecular Weight 265.221 g/mol
SMILES OC1=C(C(c2c(c(c(c(c2O)O)CC)O)C1=O)=O)N
SPLASH splash10-014i-0090000000-c581bdf883e8f3edceff
Source of Spectrum X2-68-1392-1
Wiley ID 1609684