Ethanol, 2-[[(6-nitro-1,3-benzodioxol-5-yl)methylene]amino]-

SpectraBase Compound ID	DbQP7Dgwvfo
InChI	InChI=1S/C10H10N2O5/c13-2-1-11-5-7-3-9-10(17-6-16-9)4-8(7)12(14)15/h3-5,13H,1-2,6H2/b11-5+
InChIKey	DVCXKUCVCWTMSG-VZUCSPMQSA-N Google Search
Mol Weight	238.2 g/mol
Molecular Formula	C10H10N2O5
Exact Mass	238.058971 g/mol

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SpectraBase Spectrum ID	I37ID5YhTFa
Name	Ethanol, 2-[[(6-nitro-1,3-benzodioxol-5-yl)methylene]amino]-
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	238.058971425 u
Formula	C10H10N2O5
InChI	InChI=1S/C10H10N2O5/c13-2-1-11-5-7-3-9-10(17-6-16-9)4-8(7)12(14)15/h3-5,13H,1-2,6H2/b11-5+
InChIKey	DVCXKUCVCWTMSG-VZUCSPMQSA-N
Molecular Weight	238.199 g/mol
SMILES	C(O)C\N=C\C1=CC=2OCOC2C=C1N(=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR)	0.959632