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5-{2-[(p-methoxyphenyl)-indol-3-yl]-ethenyl}(3-methyl-4-nitro)isoxazole
SpectraBase Compound ID IMl1ELSCaTA
InChI InChI=1S/C21H17N3O4/c1-13-21(24(25)26)19(28-23-13)12-11-17-16-5-3-4-6-18(16)22-20(17)14-7-9-15(27-2)10-8-14/h3-12,22H,1-2H3/b12-11+
InChIKey BVGVQTKABRYDNO-VAWYXSNFSA-N
Mol Weight 375.38 g/mol
Molecular Formula C21H17N3O4
Exact Mass 375.121906 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2LMtfG3Rdo5
Name 5-{2-[(p-methoxyphenyl)-indol-3-yl]-ethenyl}(3-methyl-4-nitro)isoxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17N3O4
InChI InChI=1S/C21H17N3O4/c1-13-21(24(25)26)19(28-23-13)12-11-17-16-5-3-4-6-18(16)22-20(17)14-7-9-15(27-2)10-8-14/h3-12,22H,1-2H3/b12-11+
InChIKey BVGVQTKABRYDNO-VAWYXSNFSA-N
Molecular Weight 375.384 g/mol
SMILES [nH]1c2c(c(c1-c1ccc(cc1)OC)\C=C\c1c(N(=O)=O)c(no1)C)cccc2
SPLASH splash10-004i-0039000000-0407c514c1c760c8f45b
Source of Spectrum O-27-901-0
Synonyms 2-(4-Methoxyphenyl)-3-[(E)-2-(3-methyl-4-nitro-5-isoxazolyl)ethenyl]-1H-indole Methyl 4-{3-[(E)-2-(3-methyl-4-nitro-5-isoxazolyl)ethenyl]-1H-indol-2-yl}phenyl ether
Wiley ID 1357197