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Benzoic acid, 3-nitro-2,6-bis(phenylmethoxy)-, methyl ester
SpectraBase Compound ID DkxMajtm5da
InChI InChI=1S/C22H19NO6/c1-27-22(24)20-19(28-14-16-8-4-2-5-9-16)13-12-18(23(25)26)21(20)29-15-17-10-6-3-7-11-17/h2-13H,14-15H2,1H3
InChIKey WNIHUIIKQMJBKZ-UHFFFAOYSA-N
Mol Weight 393.4 g/mol
Molecular Formula C22H19NO6
Exact Mass 393.121237 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5DkWEm1AZbF
Name Benzoic acid, 3-nitro-2,6-bis(phenylmethoxy)-, methyl ester
Alternate Name(s) Methyl 2,6-bis(benzyloxy)-3-nitrobenzoate 3-Nitro-2,6-bis(phenylmethoxy)benzoic acid methyl ester Methyl 2,6-dibenzyloxy-3-nitro-benzoate Methyl 3-nitro-2,6-bis(phenylmethoxy)benzoate
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Formula C22H19NO6
InChI InChI=1S/C22H19NO6/c1-27-22(24)20-19(28-14-16-8-4-2-5-9-16)13-12-18(23(25)26)21(20)29-15-17-10-6-3-7-11-17/h2-13H,14-15H2,1H3
InChIKey WNIHUIIKQMJBKZ-UHFFFAOYSA-N
Molecular Weight 393.395 g/mol
SMILES COC(=O)c1c(OCc2ccccc2)ccc([N+]([O-])=O)c1OCc1ccccc1
SPLASH splash10-0006-9000000000-f59581be07b26662aa57
Source of Spectrum JX-2015-3-1902
Wiley ID 1725364