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(1R,2S,3R,4R)-3-(3',4'-Methylenedioxyphenyl)-2,4-dinitro-1,2,3,4-tetrahydronaphthalen-1-ol

View entire compound with spectra: 1 MS (GC)

(1R,2S,3R,4R)-3-(3',4'-Methylenedioxyphenyl)-2,4-dinitro-1,2,3,4-tetrahydronaphthalen-1-ol
SpectraBase Compound ID KZVLErFRjSg
InChI InChI=1S/C17H14N2O7/c20-17-11-4-2-1-3-10(11)15(18(21)22)14(16(17)19(23)24)9-5-6-12-13(7-9)26-8-25-12/h1-7,14-17,20H,8H2/t14-,15+,16+,17-/m1/s1
InChIKey FUDOLIRWDWXQKQ-LTIDMASMSA-N
Mol Weight 358.31 g/mol
Molecular Formula C17H14N2O7
Exact Mass 358.080101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7SFnveiq10i
Name (1R,2S,3R,4R)-3-(3',4'-Methylenedioxyphenyl)-2,4-dinitro-1,2,3,4-tetrahydronaphthalen-1-ol
Alternate Name(s) (1R,2S,3R,4R)-3-(benzo[d][1,3]dioxol-5-yl)-2,4-dinitro-1,2,3,4-tetrahydronaphthalen-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14N2O7
InChI InChI=1S/C17H14N2O7/c20-17-11-4-2-1-3-10(11)15(18(21)22)14(16(17)19(23)24)9-5-6-12-13(7-9)26-8-25-12/h1-7,14-17,20H,8H2/t14-,15+,16+,17-/m1/s1
InChIKey FUDOLIRWDWXQKQ-LTIDMASMSA-N
Literature Reference DOI 10.1002/adsc.201300039
Molecular Weight 358.306 g/mol
SMILES O[C@@]1(c2ccccc2[C@]([N+](=O)[O-])([C@@](c2cc3c(cc2)OCO3)([C@@]1([N+](=O)[O-])[H])[H])[H])[H]
SPLASH splash10-00ks-3970000000-44f89fc38c0aa36979b6
Source of Spectrum ASC-355-1132-5i
Wiley ID 1762021