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7-[2'-Hydroxy-5'-nitrobenzyl]-5,6,7,8,9,10-hexahydro-2H-1,13,4,7,10-benzodioxatriazacyclopentadecine-3,11(4H,12H)-dione
SpectraBase Compound ID 4TFyR7CbXh0
InChI InChI=1S/C21H24N4O7/c26-17-6-5-16(25(29)30)11-15(17)12-24-9-7-22-20(27)13-31-18-3-1-2-4-19(18)32-14-21(28)23-8-10-24/h1-6,11,26H,7-10,12-14H2,(H,22,27)(H,23,28)
InChIKey GBWHLPQVWSNDLF-UHFFFAOYSA-N
Mol Weight 444.44 g/mol
Molecular Formula C21H24N4O7
Exact Mass 444.164499 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H8ofMdwnxKg
Name 7-[2'-Hydroxy-5'-nitrobenzyl]-5,6,7,8,9,10-hexahydro-2H-1,13,4,7,10-benzodioxatriazacyclopentadecine-3,11(4H,12H)-dione
Alternate Name(s) 8-[(2-hydroxy-5-nitrophenyl)methyl]-2,14-dioxa-5,8,11-triazabicyclo[13.4.0]nonadeca-1(19),15,17-triene-4,12-dione 8-[(2-hydroxy-5-nitro-phenyl)methyl]-2,14-dioxa-5,8,11-triazabicyclo[13.4.0]nonadeca-1(19),15,17-triene-4,12-dione 8-[(5-nitro-2-oxidanyl-phenyl)methyl]-2,14-dioxa-5,8,11-triazabicyclo[13.4.0]nonadeca-1(19),15,17-triene-4,12-dione
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Formula C21H24N4O7
InChI InChI=1S/C21H24N4O7/c26-17-6-5-16(25(29)30)11-15(17)12-24-9-7-22-20(27)13-31-18-3-1-2-4-19(18)32-14-21(28)23-8-10-24/h1-6,11,26H,7-10,12-14H2,(H,22,27)(H,23,28)
InChIKey GBWHLPQVWSNDLF-UHFFFAOYSA-N
Molecular Weight 444.444 g/mol
SMILES N1CCN(Cc2cc(ccc2O)N(=O)=O)CCNC(=O)COc2ccccc2OCC1=O
SPLASH splash10-0693-9210000000-959b6236f6f582fc4009
Source of Spectrum I-86-433-19
Wiley ID 1691570