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sigmosceptrin-C methyl ester
SpectraBase Compound ID DpqIgmuiwjp
InChI InChI=1S/C20H34O2/c1-14(18(21)22-6)10-12-19(4)16(3)11-13-20(5)15(2)8-7-9-17(19)20/h14,16-17H,2,7-13H2,1,3-6H3/t14?,16-,17?,19-,20+/m1/s1
InChIKey GFOMPUPZLBFYDF-SFBFCYGASA-N
Mol Weight 306.5 g/mol
Molecular Formula C20H34O2
Exact Mass 306.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8eeYumEBdQO
Name sigmosceptrin-C methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H34O2
InChI InChI=1S/C20H34O2/c1-14(18(21)22-6)10-12-19(4)16(3)11-13-20(5)15(2)8-7-9-17(19)20/h14,16-17H,2,7-13H2,1,3-6H3/t14?,16-,17?,19-,20+/m1/s1
InChIKey GFOMPUPZLBFYDF-SFBFCYGASA-N
Molecular Weight 306.490 g/mol
SMILES [C@]12(C([C@@](CC[C@@](C(=O)OC)(C)[H])(C)[C@](CC2)(C)[H])CCCC1=C)C
SPLASH splash10-0006-0900000000-4fadd47244a6cd1c958c
Source of Spectrum JA-50-1137-0
Synonyms Methyl (2R)-4-[(1S,2R,4aS)-1,2,4a-trimethyl-5-methylenedecahydro-1-naphthalenyl]-2-methylbutanoate
Wiley ID 1308607