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4-Allyl-1-(2-ethoxycarbonyl-1,4-dioxide-3-phenylquinoxaline-7-yl)methylidene thiosemicarbazide
SpectraBase Compound ID Gr7o3tDrGiT
InChI InChI=1S/C22H21N5O4S/c1-3-12-23-22(32)25-24-14-15-10-11-17-18(13-15)27(30)20(21(28)31-4-2)19(26(17)29)16-8-6-5-7-9-16/h3,5-11,13-14H,1,4,12H2,2H3,(H2,23,25,32)/b24-14+
InChIKey YRWXZZBAXIAIRK-ZVHZXABRSA-N
Mol Weight 451.5 g/mol
Molecular Formula C22H21N5O4S
Exact Mass 451.131425 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2l3rkEBmGdg
Name 4-Allyl-1-(2-ethoxycarbonyl-1,4-dioxide-3-phenylquinoxaline-7-yl)methylidene thiosemicarbazide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21N5O4S
InChI InChI=1S/C22H21N5O4S/c1-3-12-23-22(32)25-24-14-15-10-11-17-18(13-15)27(30)20(21(28)31-4-2)19(26(17)29)16-8-6-5-7-9-16/h3,5-11,13-14H,1,4,12H2,2H3,(H2,23,25,32)/b24-14+
InChIKey YRWXZZBAXIAIRK-ZVHZXABRSA-N
Molecular Weight 451.501 g/mol
SMILES N(C(=S)NCC=C)\N=C\c1cc2[n+](c(c([n+]([O-])c2cc1)-c1ccccc1)C(=O)OCC)[O-]
SPLASH splash10-0arr-6593000000-58350a11b75972b031e2
Source of Spectrum F2-45-2161-23
Wiley ID 1689144