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.beta.-Methyl 2-nitroxy-3,5-di-p-nitrobenzoyl-d-arabinose
SpectraBase Compound ID 4SwLVGRtD5n
InChI InChI=1S/C20H17N3O13/c1-32-20-17(36-23(30)31)16(35-19(25)12-4-8-14(9-5-12)22(28)29)15(34-20)10-33-18(24)11-2-6-13(7-3-11)21(26)27/h2-9,15-17,20H,10H2,1H3
InChIKey BKIKULNUEIETOO-UHFFFAOYSA-N
Mol Weight 507.36 g/mol
Molecular Formula C20H17N3O13
Exact Mass 507.076138 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8rjrTjhohj8
Name .beta.-Methyl 2-nitroxy-3,5-di-p-nitrobenzoyl-d-arabinose
CAS Registry Number 4153-33-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H17N3O13
InChI InChI=1S/C20H17N3O13/c1-32-20-17(36-23(30)31)16(35-19(25)12-4-8-14(9-5-12)22(28)29)15(34-20)10-33-18(24)11-2-6-13(7-3-11)21(26)27/h2-9,15-17,20H,10H2,1H3
InChIKey BKIKULNUEIETOO-UHFFFAOYSA-N
Molecular Weight 507.364 g/mol
SMILES C1(C(C(COC(c2ccc(cc2)N(=O)=O)=O)OC1OC)OC(=O)c1ccc(cc1)N(=O)=O)ON(=O)=O
SPLASH splash10-0udi-8900000000-6b016cc646764c0ec24d
Source of Spectrum NP-15-7637-0
Synonyms .alpha.-Methyl 2-nitroxy-3,5-O-di-p-nitrobenzoyl-d-arabinose 4-Nitrobenzoic acid [5-methoxy-4-nitrooxy-3-[(4-nitrophenyl)-oxomethoxy]-2-oxolanyl]methyl ester [5-methoxy-3-(4-nitrobenzoyl)oxy-4-nitrooxyoxolan-2-yl]methyl 4-nitrobenzoate [5-methoxy-3-(4-nitrobenzoyl)oxy-4-nitrooxy-tetrahydrofuran-2-yl]methyl 4-nitrobenzoate [5-methoxy-4-nitrooxy-3-(4-nitrophenyl)carbonyloxy-oxolan-2-yl]methyl 4-nitrobenzoate
Wiley ID 1112822