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KADSURALIGNAN_H
SpectraBase Compound ID EC6HoxQpjF2
InChI InChI=1S/C22H26O6/c1-11-6-13-7-16(25-4)22(26-5)20(23)19(13)18(12(11)2)14-8-15(24-3)21-17(9-14)27-10-28-21/h7-9,11-12,18,23H,6,10H2,1-5H3/t11-,12-,18-/m1/s1
InChIKey HAPHUWWEOOCTDA-SEDUGSJDSA-N
Mol Weight 386.44 g/mol
Molecular Formula C22H26O6
Exact Mass 386.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Rz9SkVnXHP
Name Kadsuralignan H
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26O6
InChI InChI=1S/C22H26O6/c1-11-6-13-7-16(25-4)22(26-5)20(23)19(13)18(12(11)2)14-8-15(24-3)21-17(9-14)27-10-28-21/h7-9,11-12,18,23H,6,10H2,1-5H3/t11-,12-,18-/m1/s1
InChIKey HAPHUWWEOOCTDA-SEDUGSJDSA-N
Molecular Weight 386.444 g/mol
SMILES Oc1c2[C@@](c3cc4OCOc4c(c3)OC)([C@](C)([C@@](Cc2cc(OC)c1OC)(C)[H])[H])[H]
SPLASH splash10-0019-2279000000-2dd9f1295e7aab36a948
Source of Spectrum G4-70-2002-1
Synonyms (6R,7R,8R)-2,3-dimethoxy-8-(7-methoxy-1,3-benzodioxol-5-yl)-6,7-dimethyl-5,6,7,8-tetrahydronaphthalen-1-ol
Wiley ID 1694835