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(6aR,10aR)-1-methoxy-6,6-dimethyl-3-pentyl-6,6a,7,8,10,10a-hexahydro-9H-benzo[c]chromen-9-one
SpectraBase Compound ID 44JfAHqFQHA
InChI InChI=1S/C21H30O3/c1-5-6-7-8-14-11-18(23-4)20-16-13-15(22)9-10-17(16)21(2,3)24-19(20)12-14/h11-12,16-17H,5-10,13H2,1-4H3/t16-,17-/m1/s1
InChIKey JVCWJGIDSNOHET-IAGOWNOFSA-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 EsZZ96M25Hd
Name (6aR,10aR)-1-methoxy-6,6-dimethyl-3-pentyl-6,6a,7,8,10,10a-hexahydro-9H-benzo[c]chromen-9-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O3
InChI InChI=1S/C21H30O3/c1-5-6-7-8-14-11-18(23-4)20-16-13-15(22)9-10-17(16)21(2,3)24-19(20)12-14/h11-12,16-17H,5-10,13H2,1-4H3/t16-,17-/m1/s1
InChIKey JVCWJGIDSNOHET-IAGOWNOFSA-N
Molecular Weight 330.468 g/mol
SMILES c12[C@]3([C@@](CCC(C3)=O)(C(Oc1cc(cc2OC)CCCCC)(C)C)[H])[H]
SPLASH splash10-0231-0394000000-0b68e3fd72bc06e07402
Source of Spectrum F-51-1026-5
Synonyms (6aR,10aR)-1-methoxy-6,6-dimethyl-3-pentyl-7,8,10,10a-tetrahydro-6aH-benzo[c]chromen-9-one (6aR,10aR)-1-methoxy-6,6-dimethyl-3-pentyl-7,8,10,10a-tetrahydro-6aH-benzo[c][1]benzopyran-9-one (6aR,10aR)-3-amyl-1-methoxy-6,6-dimethyl-7,8,10,10a-tetrahydro-6aH-benzo[c]chromen-9-one
Wiley ID 790811