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6-Amino-2,2-dimethyl-5-nitro-2H-1-benzopyran
SpectraBase Compound ID CSOx3BKIC4x
InChI InChI=1S/C11H12N2O3/c1-11(2)6-5-7-9(16-11)4-3-8(12)10(7)13(14)15/h3-6H,12H2,1-2H3
InChIKey WQLVFTMYRBQMAP-UHFFFAOYSA-N
Mol Weight 220.23 g/mol
Molecular Formula C11H12N2O3
Exact Mass 220.084792 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EgXymwbI4AV
Name 6-Amino-2,2-dimethyl-5-nitro-2H-1-benzopyran
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 220.084792251 u
Formula C11H12N2O3
InChI InChI=1S/C11H12N2O3/c1-11(2)6-5-7-9(16-11)4-3-8(12)10(7)13(14)15/h3-6H,12H2,1-2H3
InChIKey WQLVFTMYRBQMAP-UHFFFAOYSA-N
Molecular Weight 220.228 g/mol
SMILES C1(N(=O)=O)=C2C=CC(OC2=CC=C1N)(C)C