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(6aR,8R,10aR)-3-amyl-6,6-dimethyl-9-methylene-7,8,10,10a-tetrahydro-6aH-benzo[c]chromene-1,8-diol
SpectraBase Compound ID I7wFXsEpH1E
InChI InChI=1S/C21H30O3/c1-5-6-7-8-14-10-18(23)20-15-9-13(2)17(22)12-16(15)21(3,4)24-19(20)11-14/h10-11,15-17,22-23H,2,5-9,12H2,1,3-4H3/t15-,16-,17-/m1/s1
InChIKey YRXPGUPXVCGYGF-BRWVUGGUSA-N
Mol Weight 330.47 g/mol
Molecular Formula C21H30O3
Exact Mass 330.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5OIjiJZbyVf
Name (6aR,8R,10aR)-3-amyl-6,6-dimethyl-9-methylene-7,8,10,10a-tetrahydro-6aH-benzo[c]chromene-1,8-diol
Alternate Name(s) (6aR,8R,10aR)-6,6-dimethyl-9-methylene-3-pentyl-7,8,10,10a-tetrahydro-6aH-benzo[c]chromene-1,8-diol (6aR,8R,10aR)-6,6-dimethyl-9-methylene-3-pentyl-7,8,10,10a-tetrahydro-6aH-benzo[c][1]benzopyran-1,8-diol (6aR,8R,10aR)-6,6-dimethyl-9-methylidene-3-pentyl-7,8,10,10a-tetrahydro-6aH-benzo[c]chromene-1,8-diol
CAS Registry Number 52522-55-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O3
InChI InChI=1S/C21H30O3/c1-5-6-7-8-14-10-18(23)20-15-9-13(2)17(22)12-16(15)21(3,4)24-19(20)11-14/h10-11,15-17,22-23H,2,5-9,12H2,1,3-4H3/t15-,16-,17-/m1/s1
InChIKey YRXPGUPXVCGYGF-BRWVUGGUSA-N
Molecular Weight 330.468 g/mol
SMILES Oc1cc(cc2c1[C@@]1(CC([C@@](C[C@]1(C(O2)(C)C)[H])(O)[H])=C)[H])CCCCC
SPLASH splash10-0535-3490000000-61b21315927effb88d85
Source of Spectrum H-57-139-7
Wiley ID 1328225