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(1R,2S,3R,4R)-3-(4'-Methoxyphenyl)-2,4-dinitro-1,2,3,4-tetrahydronaphthalen-1-ol
SpectraBase Compound ID FFf7m5PaJrZ
InChI InChI=1S/C17H16N2O6/c1-25-11-8-6-10(7-9-11)14-15(18(21)22)12-4-2-3-5-13(12)17(20)16(14)19(23)24/h2-9,14-17,20H,1H3/t14-,15+,16+,17-/m1/s1
InChIKey NVAPKNUVVSCTLG-LTIDMASMSA-N
Mol Weight 344.32 g/mol
Molecular Formula C17H16N2O6
Exact Mass 344.100836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 46Ja0Q48gJ7
Name (1R,2S,3R,4R)-3-(4'-Methoxyphenyl)-2,4-dinitro-1,2,3,4-tetrahydronaphthalen-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N2O6
InChI InChI=1S/C17H16N2O6/c1-25-11-8-6-10(7-9-11)14-15(18(21)22)12-4-2-3-5-13(12)17(20)16(14)19(23)24/h2-9,14-17,20H,1H3/t14-,15+,16+,17-/m1/s1
InChIKey NVAPKNUVVSCTLG-LTIDMASMSA-N
Literature Reference DOI 10.1002/adsc.201300039
Molecular Weight 344.323 g/mol
SMILES O[C@]1([C@]([C@@]([C@](c2ccccc12)([N+](=O)[O-])[H])(c1ccc(cc1)OC)[H])([N+](=O)[O-])[H])[H]
SPLASH splash10-0v59-0980000000-85e38c0b25b5b201aa07
Source of Spectrum ASC-355-1131-5c
Synonyms (1R,2S,3R,4R)-3-(4-methoxyphenyl)-2,4-dinitro-1,2,3,4-tetrahydronaphthalen-1-ol
Wiley ID 1762017