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3,7,8-Tris(4-methoxyphenyl)pyrrolo[2,1-c][1,4]oxazin-1-one
SpectraBase Compound ID 2sjMl1EUNYH
InChI InChI=1S/C28H23NO5/c1-31-21-10-4-18(5-11-21)24-16-29-17-25(19-6-12-22(32-2)13-7-19)34-28(30)27(29)26(24)20-8-14-23(33-3)15-9-20/h4-17H,1-3H3
InChIKey PJJBDRATHLDYLE-UHFFFAOYSA-N
Mol Weight 453.49 g/mol
Molecular Formula C28H23NO5
Exact Mass 453.157623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IF9Zbwdm5Bk
Name 3,7,8-Tris(4-methoxyphenyl)pyrrolo[2,1-c][1,4]oxazin-1-one
Alternate Name(s) 3,7,8-tris(4-methoxyphenyl)-1-pyrrolo[2,1-c][1,4]oxazinone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H23NO5
InChI InChI=1S/C28H23NO5/c1-31-21-10-4-18(5-11-21)24-16-29-17-25(19-6-12-22(32-2)13-7-19)34-28(30)27(29)26(24)20-8-14-23(33-3)15-9-20/h4-17H,1-3H3
InChIKey PJJBDRATHLDYLE-UHFFFAOYSA-N
Molecular Weight 453.494 g/mol
SMILES c12[n](cc(c2-c2ccc(cc2)OC)-c2ccc(cc2)OC)C=C(OC1=O)c1ccc(cc1)OC
SPLASH splash10-0udi-0100900000-9b06ec5883279ce731f3
Source of Spectrum J-60-6640-20
Wiley ID 1388536