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3-Hydroxy-2,3-bis(hydroxymethyl)-6,7-dimethoxy-1-(3,4-dimethoxyphenyl)-1,2,3,4-tetrahydronaphthalene
SpectraBase Compound ID De46cn2mzO0
InChI InChI=1S/C22H28O7/c1-26-17-6-5-13(7-18(17)27-2)21-15-9-20(29-4)19(28-3)8-14(15)10-22(25,12-24)16(21)11-23/h5-9,16,21,23-25H,10-12H2,1-4H3/t16-,21-,22-/m1/s1
InChIKey PKMNTFZWHYHFDL-NPFVIJTESA-N
Mol Weight 404.46 g/mol
Molecular Formula C22H28O7
Exact Mass 404.183503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ivs1PfYIdOU
Name 3-Hydroxy-2,3-bis(hydroxymethyl)-6,7-dimethoxy-1-(3,4-dimethoxyphenyl)-1,2,3,4-tetrahydronaphthalene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28O7
InChI InChI=1S/C22H28O7/c1-26-17-6-5-13(7-18(17)27-2)21-15-9-20(29-4)19(28-3)8-14(15)10-22(25,12-24)16(21)11-23/h5-9,16,21,23-25H,10-12H2,1-4H3/t16-,21-,22-/m1/s1
InChIKey PKMNTFZWHYHFDL-NPFVIJTESA-N
Molecular Weight 404.459 g/mol
SMILES OC[C@@]1([C@@](c2c(C[C@]1(CO)O)cc(c(c2)OC)OC)(c1cc(OC)c(cc1)OC)[H])[H]
SPLASH splash10-004i-0009000000-12ac574f0069c5095f9a
Source of Spectrum F-55-13803-13
Synonyms (2S,3S,4R)-4-(3,4-Dimethoxy-phenyl)-2,3-bis-hydroxymethyl-6,7-dimethoxy-1,2,3,4-tetrahydro-naphthalen-2-ol 4-(3,4-dimethoxyphenyl)-2,3-bis(hydroxymethyl)-6,7-dimethoxy-1,2,3,4-tetrahydro-2-naphthalenol (2S,3S,4R)-4-(3,4-dimethoxyphenyl)-2,3-bis(hydroxymethyl)-6,7-dimethoxy-tetralin-2-ol (2S,3S,4R)-4-(3,4-dimethoxyphenyl)-2,3-bis(hydroxymethyl)-6,7-dimethoxy-3,4-dihydro-1H-naphthalen-2-ol
Wiley ID 839723