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benzyl N-[1-[3-[N-(benzyloxycarbonylamino)-C-methyl-carbonimidoyl]-2,4-dihydroxy-phenyl]ethylideneamino]carbamate
SpectraBase Compound ID 79azBc3AsOY
InChI InChI=1S/C26H26N4O6/c1-17(27-29-25(33)35-15-19-9-5-3-6-10-19)21-13-14-22(31)23(24(21)32)18(2)28-30-26(34)36-16-20-11-7-4-8-12-20/h3-14,31-32H,15-16H2,1-2H3,(H,29,33)(H,30,34)
InChIKey PBERKXXTMYRGNO-UHFFFAOYSA-N
Mol Weight 490.52 g/mol
Molecular Formula C26H26N4O6
Exact Mass 490.185235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6uodw7P1Gm5
Name benzyl N-[1-[3-[N-(benzyloxycarbonylamino)-C-methyl-carbonimidoyl]-2,4-dihydroxy-phenyl]ethylideneamino]carbamate
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Formula C26H26N4O6
InChI InChI=1S/C26H26N4O6/c1-17(27-29-25(33)35-15-19-9-5-3-6-10-19)21-13-14-22(31)23(24(21)32)18(2)28-30-26(34)36-16-20-11-7-4-8-12-20/h3-14,31-32H,15-16H2,1-2H3,(H,29,33)(H,30,34)
InChIKey PBERKXXTMYRGNO-UHFFFAOYSA-N
Instrument Name Finnigan MAT 4500 or Kratos MS-50
Ionization Type EI
Literature Reference DOI 10.1002/rcm.1290090926
Molecular Weight 490.516 g/mol
SMILES N(N=C(c1ccc(c(c1O)C(C)=NNC(OCc1ccccc1)=O)O)C)C(=O)OCc1ccccc1
SPLASH splash10-0006-9200000000-1ea112e35edcb267931e
Source of Spectrum RCM-9-851-1g
Wiley ID 1835919