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(2S,3R)-5-[2-[(2S,3R)-2,3-dihydroxytetralin-5-yl]ethynyl]tetralin-2,3-diol
SpectraBase Compound ID Hv8zAqEeVr5
InChI InChI=1S/C22H22O4/c23-19-9-15-5-1-3-13(17(15)11-21(19)25)7-8-14-4-2-6-16-10-20(24)22(26)12-18(14)16/h1-6,19-26H,9-12H2/t19-,20-,21+,22+/m0/s1
InChIKey VSOQVDDWMQXTQW-FNAHDJPLSA-N
Mol Weight 350.41 g/mol
Molecular Formula C22H22O4
Exact Mass 350.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EN3pfee651n
Name (2S,3R)-5-[2-[(2S,3R)-2,3-dihydroxytetralin-5-yl]ethynyl]tetralin-2,3-diol
Alternate Name(s) (2S,3R)-5-[2-[(6S,7R)-6,7-bis(oxidanyl)-5,6,7,8-tetrahydronaphthalen-1-yl]ethynyl]-1,2,3,4-tetrahydronaphthalene-2,3-diol (2S,3R)-5-[2-[(6S,7R)-6,7-dihydroxy-5,6,7,8-tetrahydronaphthalen-1-yl]ethynyl]-1,2,3,4-tetrahydronaphthalene-2,3-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22O4
InChI InChI=1S/C22H22O4/c23-19-9-15-5-1-3-13(17(15)11-21(19)25)7-8-14-4-2-6-16-10-20(24)22(26)12-18(14)16/h1-6,19-26H,9-12H2/t19-,20-,21+,22+/m0/s1
InChIKey VSOQVDDWMQXTQW-FNAHDJPLSA-N
Molecular Weight 350.414 g/mol
SMILES O[C@@]1(Cc2c(C#Cc3c4c(C[C@@]([C@@](C4)(O)[H])(O)[H])ccc3)cccc2C[C@@]1(O)[H])[H]
SPLASH splash10-0udi-0029000000-9b4e52d55267b85ccded
Source of Spectrum J-66-7137-5
Wiley ID 1536098