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(1S,2S,4R,8S)-1,2-Dibromo-8-hydroxy-P-menth-9-yl-4'-nitrobenzoate

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(1S,2S,4R,8S)-1,2-Dibromo-8-hydroxy-P-menth-9-yl-4'-nitrobenzoate
SpectraBase Compound ID X5NODXYDSj
InChI InChI=1S/C17H21Br2NO5/c1-16(19)8-7-12(9-14(16)18)17(2,22)10-25-15(21)11-3-5-13(6-4-11)20(23)24/h3-6,12,14,22H,7-10H2,1-2H3
InChIKey TXZFIXVWZRNBJP-UHFFFAOYSA-N
Mol Weight 479.17 g/mol
Molecular Formula C17H21Br2NO5
Exact Mass 476.978649 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1xgaBsIyOZt
Name (1S,2S,4R,8R)-1,2-Dibromo-8-hydroxy-P-menth-9-yl-4'-nitrobenzoate
Comments broad-band decoupling (BB)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H21Br2NO5
InChI InChI=1S/C17H21Br2NO5/c1-16(19)8-7-12(9-14(16)18)17(2,22)10-25-15(21)11-3-5-13(6-4-11)20(23)24/h3-6,12,14,22H,7-10H2,1-2H3
InChIKey TXZFIXVWZRNBJP-UHFFFAOYSA-N
Instrument Name SF = 100 MHz
Literature Reference Austr. J. Chem. 39, 21 (1986).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3