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3-[2-(3,4-dihydroxyphenyl)ethylamino]-4-ethoxy-cyclobut-3-ene-1,2-dione
SpectraBase Compound ID FzAQrV1msmq
InChI InChI=1S/C14H15NO5/c1-2-20-14-11(12(18)13(14)19)15-6-5-8-3-4-9(16)10(17)7-8/h3-4,7,15-17H,2,5-6H2,1H3
InChIKey UUXRVHVMJOBHQK-UHFFFAOYSA-N
Mol Weight 277.28 g/mol
Molecular Formula C14H15NO5
Exact Mass 277.095023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LS9fDHxgJ2p
Name 3-[2-(3,4-dihydroxyphenyl)ethylamino]-4-ethoxy-cyclobut-3-ene-1,2-dione
CAS Registry Number 131589-05-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15NO5
InChI InChI=1S/C14H15NO5/c1-2-20-14-11(12(18)13(14)19)15-6-5-8-3-4-9(16)10(17)7-8/h3-4,7,15-17H,2,5-6H2,1H3
InChIKey UUXRVHVMJOBHQK-UHFFFAOYSA-N
Molecular Weight 277.276 g/mol
SMILES N(C1=C(OCC)C(C1=O)=O)CCc1ccc(c(c1)O)O
SPLASH splash10-00g3-3950000000-3525fbac0eaa960844f2
Source of Spectrum K-124-1219-3
Synonyms 3-[2-(3,4-dihydroxyphenyl)ethylamino]-4-ethoxy-cyclobut-3-ene-1,2-quinone 3-[2-[3,4-bis(oxidanyl)phenyl]ethylamino]-4-ethoxy-cyclobut-3-ene-1,2-dione
Wiley ID 1280936