2,2,5,6-Tetramethyl-2H-naphtho[1,8-bc]furan, picrate

SpectraBase Compound ID	7XmO5Z0FJOo
InChI	InChI=1S/C15H16O.C6H3N3O7/c1-9-5-7-11-14-12(16-15(11,3)4)8-6-10(2)13(9)14;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h5-8H,1-4H3;1-2,10H
InChIKey	DHPUAJWZIWZIHS-UHFFFAOYSA-N Google Search
Mol Weight	441.4 g/mol
Molecular Formula	C21H19N3O8
Exact Mass	441.117215 g/mol

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SpectraBase Spectrum ID	AsJThsIhQ2X
Name	2,2,5,6-Tetramethyl-2H-naphtho[1,8-bc]furan, picrate
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	441.117214576 u
Formula	C21H19N3O8
InChI	InChI=1S/C15H16O.C6H3N3O7/c1-9-5-7-11-14-12(16-15(11,3)4)8-6-10(2)13(9)14;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h5-8H,1-4H3;1-2,10H
InChIKey	DHPUAJWZIWZIHS-UHFFFAOYSA-N
Molecular Weight	441.396 g/mol
SMILES	N(=O)(=O)C1=CC(=C(C(=C1)N(=O)=O)O)N(=O)=O.CC=1C2=C3C(=CC1)OC(C3=CC=C2C)(C)C
Spectrum/Structure Validation Score (Raman)	0.918102