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(1R,2S,3R,4R)-3-(3'-Chlorophenyl)-2,4-dinitro-1,2,3,4-tetrahydronaphthalen-1-ol
SpectraBase Compound ID FfK8nCcNzj1
InChI InChI=1S/C16H13ClN2O5/c17-10-5-3-4-9(8-10)13-14(18(21)22)11-6-1-2-7-12(11)16(20)15(13)19(23)24/h1-8,13-16,20H/t13-,14+,15+,16-/m1/s1
InChIKey ARFHFCLVVKCMPC-FXUDXRNXSA-N
Mol Weight 348.74 g/mol
Molecular Formula C16H13ClN2O5
Exact Mass 348.051299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gl2UnGpBMlf
Name (1R,2S,3R,4R)-3-(3'-Chlorophenyl)-2,4-dinitro-1,2,3,4-tetrahydronaphthalen-1-ol
Alternate Name(s) (1R,2S,3R,4R)-3-(3-chlorophenyl)-2,4-dinitro-1,2,3,4-tetrahydronaphthalen-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13ClN2O5
InChI InChI=1S/C16H13ClN2O5/c17-10-5-3-4-9(8-10)13-14(18(21)22)11-6-1-2-7-12(11)16(20)15(13)19(23)24/h1-8,13-16,20H/t13-,14+,15+,16-/m1/s1
InChIKey ARFHFCLVVKCMPC-FXUDXRNXSA-N
Literature Reference DOI 10.1002/adsc.201300039
Molecular Weight 348.742 g/mol
SMILES O[C@]1([C@]([C@@]([C@](c2ccccc12)([N+](=O)[O-])[H])(c1cc(ccc1)Cl)[H])([N+](=O)[O-])[H])[H]
SPLASH splash10-0a4i-0190000000-efb5fecb2407ccbaddc9
Source of Spectrum ASC-355-1131-5g
Wiley ID 1762019