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Benzoic acid, 4-(1,3-benzodioxol-5-yloxy)-3-nitro-, methyl ester
SpectraBase Compound ID 58GSkAQj4pb
InChI InChI=1S/C15H11NO7/c1-20-15(17)9-2-4-12(11(6-9)16(18)19)23-10-3-5-13-14(7-10)22-8-21-13/h2-7H,8H2,1H3
InChIKey UOIAVEYZNBADLI-UHFFFAOYSA-N
Mol Weight 317.25 g/mol
Molecular Formula C15H11NO7
Exact Mass 317.053552 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JkvJT9YELCA
Name Benzoic acid, 4-(1,3-benzodioxol-5-yloxy)-3-nitro-, methyl ester
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Formula C15H11NO7
InChI InChI=1S/C15H11NO7/c1-20-15(17)9-2-4-12(11(6-9)16(18)19)23-10-3-5-13-14(7-10)22-8-21-13/h2-7H,8H2,1H3
InChIKey UOIAVEYZNBADLI-UHFFFAOYSA-N
Molecular Weight 317.253 g/mol
SMILES c1c(Oc2c(cc(cc2)C(OC)=O)N(=O)=O)ccc2OCOc12
SPLASH splash10-0f79-9600000000-8e11b0b12a7eb6082d4c
Source of Spectrum IY-2-5088-1
Synonyms Methyl 4-(2H-1,3-benzodioxol-5-yloxy)-3-nitrobenzoate 4-(1,3-benzodioxol-5-yloxy)-3-nitrobenzoic acid methyl ester Methyl 4-(1,3-benzodioxol-5-yloxy)-3-nitrobenzoate Methyl 4-(1,3-benzodioxol-5-yloxy)-3-nitro-benzoate
Wiley ID 1658864