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(E)-Ethyl 3-(4,9-Dioxo-2-naphth[2,3-d]imidazolylthio)acrylate
SpectraBase Compound ID 7mtYD9BKtZ6
InChI InChI=1S/C16H12N2O4S/c1-2-22-11(19)7-8-23-16-17-12-13(18-16)15(21)10-6-4-3-5-9(10)14(12)20/h3-8H,2H2,1H3,(H,17,18)/b8-7+
InChIKey VHEYABSNKJZGTP-BQYQJAHWSA-N
Mol Weight 328.34 g/mol
Molecular Formula C16H12N2O4S
Exact Mass 328.051778 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6f3ncQO60YY
Name (E)-Ethyl 3-(4,9-Dioxo-2-naphth[2,3-d]imidazolylthio)acrylate
Alternate Name(s) Ethyl (2E)-3-[(4,9-dioxo-4,9-dihydro-1H-naphtho[2,3-d]imidazol-2-yl)sulfanyl]-2-propenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12N2O4S
InChI InChI=1S/C16H12N2O4S/c1-2-22-11(19)7-8-23-16-17-12-13(18-16)15(21)10-6-4-3-5-9(10)14(12)20/h3-8H,2H2,1H3,(H,17,18)/b8-7+
InChIKey VHEYABSNKJZGTP-BQYQJAHWSA-N
Molecular Weight 328.342 g/mol
SMILES [nH]1c(nc2c1C(c1c(C2=O)cccc1)=O)S\C=C\C(=O)OCC
SPLASH splash10-0a4i-0090000000-872d0a0288d38098821d
Source of Spectrum AJ-61-2022-9
Wiley ID 1326025