For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
[2-(2-Hydroxyphenyl)-1,3-benzoxazin-4-yliden]-4-nitrophenylacetonitrile
SpectraBase Compound ID 4Hfoi87XBSN
InChI InChI=1S/C22H13N3O4/c23-13-18(14-9-11-15(12-10-14)25(27)28)21-17-6-2-4-8-20(17)29-22(24-21)16-5-1-3-7-19(16)26/h1-12,26H/b21-18+
InChIKey GZZLUWFPOJQTPH-DYTRJAOYSA-N
Mol Weight 383.36 g/mol
Molecular Formula C22H13N3O4
Exact Mass 383.090606 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID B0aWnbP6g9g
Name [2-(2-Hydroxyphenyl)-1,3-benzoxazin-4-yliden]-4-nitrophenylacetonitrile
Alternate Name(s) (2Z)-[2-(2-hydroxyphenyl)-4H-1,3-benzoxazin-4-ylidene](4-nitrophenyl)ethanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H13N3O4
InChI InChI=1S/C22H13N3O4/c23-13-18(14-9-11-15(12-10-14)25(27)28)21-17-6-2-4-8-20(17)29-22(24-21)16-5-1-3-7-19(16)26/h1-12,26H/b21-18+
InChIKey GZZLUWFPOJQTPH-DYTRJAOYSA-N
Molecular Weight 383.363 g/mol
SMILES Oc1c(C=2Oc3c(\C(=C/(c4ccc(cc4)N(=O)=O)C#N)N2)cccc3)cccc1
SPLASH splash10-03k9-0907000000-c1baf59c52b158f0da3f
Source of Spectrum SO-0-536-5
Wiley ID 1538571