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Royleanone 12-methyl ether
SpectraBase Compound ID 4m4TNVwskZj
InChI InChI=1S/C21H30O3/c1-12(2)15-17(22)13-8-9-14-20(3,4)10-7-11-21(14,5)16(13)18(23)19(15)24-6/h12,14H,7-11H2,1-6H3/t14-,21-/m0/s1
InChIKey PENHWEWUWBAUHZ-QKKBWIMNSA-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 J5JVGyEVyNu
Name Royleanone 12-methyl ether
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O3
InChI InChI=1S/C21H30O3/c1-12(2)15-17(22)13-8-9-14-20(3,4)10-7-11-21(14,5)16(13)18(23)19(15)24-6/h12,14H,7-11H2,1-6H3/t14-,21-/m0/s1
InChIKey PENHWEWUWBAUHZ-QKKBWIMNSA-N
Literature Reference DOI 10.1002/pca.1130
Molecular Weight 330.468 g/mol
SMILES CC1(CCC[C@]2([C@]1(CCC=1C(C(=C(C(C21)=O)OC)C(C)C)=O)[H])C)C
SPLASH splash10-015c-8937000000-9df0a4f4a0903c1badee
Source of Spectrum PA-20-324-2
Synonyms (4bS,8aS)-2-isopropyl-3-methoxy-4b,8,8-trimethyl-4b,5,6,7,8,8a,9,10-octahydrophenanthrene-1,4-dione
Wiley ID 1787629