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(2E)-3-(4,5-Dimethoxy-2-nitrophenyl)-2-(4-methylphenyl)prop-2-enoic Acid
SpectraBase Compound ID 7zFnAc7aGoQ
InChI InChI=1S/C18H17NO6/c1-11-4-6-12(7-5-11)14(18(20)21)8-13-9-16(24-2)17(25-3)10-15(13)19(22)23/h4-10H,1-3H3,(H,20,21)/b14-8+
InChIKey PXRJPSFTQSXAPK-RIYZIHGNSA-N
Mol Weight 343.34 g/mol
Molecular Formula C18H17NO6
Exact Mass 343.105587 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5snPNkYMeMK
Name (2E)-3-(4,5-Dimethoxy-2-nitrophenyl)-2-(4-methylphenyl)prop-2-enoic Acid
Alternate Name(s) (E)-3-(4,5-dimethoxy-2-nitrophenyl)-2-(p-tolyl)acrylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17NO6
InChI InChI=1S/C18H17NO6/c1-11-4-6-12(7-5-11)14(18(20)21)8-13-9-16(24-2)17(25-3)10-15(13)19(22)23/h4-10H,1-3H3,(H,20,21)/b14-8+
InChIKey PXRJPSFTQSXAPK-RIYZIHGNSA-N
Literature Reference DOI 10.1002/cbdv.201200322
Molecular Weight 343.335 g/mol
SMILES OC(\C(=C\c1c(cc(c(c1)OC)OC)[N+](=O)[O-])c1ccc(cc1)C)=O
SPLASH splash10-00kb-1980000000-5f820e0f7f108b97f5a5
Source of Spectrum CBD-9-2523-(E)_5c
Wiley ID 1771095