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4H-1,3-Benzodioxin, 2-methyl-6-nitro-
SpectraBase Compound ID KnWv8Gdz1QC
InChI InChI=1S/C9H9NO4/c1-6-13-5-7-4-8(10(11)12)2-3-9(7)14-6/h2-4,6H,5H2,1H3
InChIKey HPAMSRJBXDAWNJ-UHFFFAOYSA-N
Mol Weight 195.17 g/mol
Molecular Formula C9H9NO4
Exact Mass 195.053158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1jZ1C0whBZ6
Name 4H-1,3-Benzodioxin, 2-methyl-6-nitro-
CAS Registry Number 25466-92-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9NO4
InChI InChI=1S/C9H9NO4/c1-6-13-5-7-4-8(10(11)12)2-3-9(7)14-6/h2-4,6H,5H2,1H3
InChIKey HPAMSRJBXDAWNJ-UHFFFAOYSA-N
Molecular Weight 195.174 g/mol
SMILES c1(N(=O)=O)cc2COC(Oc2cc1)C
SPLASH splash10-0fvm-9500000000-7c746b56218d999fd528
Source of Spectrum B-30-678-1
Synonyms 1,3-Benzodioxan, 2-methyl-6-nitro- 2-Methyl-6-nitro-4H-1,3-benzodioxin 2-Methyl-6-nitrobenzo dioxane
Wiley ID 1191845