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2-(benzoyloxy)-5-(4-nitrophenylazo)-1,6-methano[10]annulene
SpectraBase Compound ID 4p9rzvMJJjA
InChI InChI=1S/C24H17N3O4/c28-24(17-6-2-1-3-7-17)31-23-15-14-22(18-8-4-5-9-19(23)16-18)26-25-20-10-12-21(13-11-20)27(29)30/h1-15H,16H2/b26-25+
InChIKey IKUQBJTYIMREID-OCEACIFDSA-N
Mol Weight 411.42 g/mol
Molecular Formula C24H17N3O4
Exact Mass 411.121906 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LNca1gH36g6
Name 2-(benzoyloxy)-5-(4-nitrophenylazo)-1,6-methano[10]annulene
Alternate Name(s) 5-[(E)-2-(4-nitrophenyl)diazenyl]bicyclo[4.4.1]undeca-1(10),2,4,6,8-pentaen-2-yl benzoate
CAS Registry Number 129216-78-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H17N3O4
InChI InChI=1S/C24H17N3O4/c28-24(17-6-2-1-3-7-17)31-23-15-14-22(18-8-4-5-9-19(23)16-18)26-25-20-10-12-21(13-11-20)27(29)30/h1-15H,16H2/b26-25+
InChIKey IKUQBJTYIMREID-OCEACIFDSA-N
Molecular Weight 411.417 g/mol
SMILES c1(N(=O)=O)ccc(\N=N\C=2C=3CC(=CC=CC3)C(=CC2)OC(=O)c2ccccc2)cc1
SPLASH splash10-0a4i-2900000000-130fa95b39d43cb63531
Source of Spectrum K-124-539-3
Wiley ID 1374135