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5,6,7,8-Tetrahydroxy-2-(2'-cyanoethenyl)-5,6,7,8-tetrahydroquinoline
SpectraBase Compound ID HH2IzlySeok
InChI InChI=1S/C12H12N2O4/c13-5-1-2-6-3-4-7-8(14-6)10(16)12(18)11(17)9(7)15/h1-4,9-12,15-18H/b2-1+
InChIKey VYCDQZKGTPCPOK-OWOJBTEDSA-N
Mol Weight 248.24 g/mol
Molecular Formula C12H12N2O4
Exact Mass 248.079707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7K3F8gj2pk3
Name 5,6,7,8-Tetrahydroxy-2-(2'-cyanoethenyl)-5,6,7,8-tetrahydroquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N2O4
InChI InChI=1S/C12H12N2O4/c13-5-1-2-6-3-4-7-8(14-6)10(16)12(18)11(17)9(7)15/h1-4,9-12,15-18H/b2-1+
InChIKey VYCDQZKGTPCPOK-OWOJBTEDSA-N
Molecular Weight 248.238 g/mol
SMILES OC1c2c(C(C(C1O)O)O)nc(cc2)\C=C\C#N
SPLASH splash10-03y0-1950000000-a80aaac4e891b73f9d21
Source of Spectrum F5-6-4497-4c
Synonyms (E)-3-(5,6,7,8-tetrahydroxy-5,6,7,8-tetrahydroquinolin-2-yl)acrylonitrile (E)-3-(5,6,7,8-tetrahydroxy-5,6,7,8-tetrahydroquinolin-2-yl)-2-propenenitrile (E)-3-(5,6,7,8-tetrahydroxy-5,6,7,8-tetrahydroquinolin-2-yl)prop-2-enenitrile (E)-3-[5,6,7,8-tetrakis(oxidanyl)-5,6,7,8-tetrahydroquinolin-2-yl]prop-2-enenitrile
Wiley ID 1733714