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(1S*)-Tetrahydro-4'-(1"-hydroxy-2"-octenyl)-5,5-dimethylspiro[1,3-dioxane-2,2'-(1'H)-pentalen]-5'(3'H)-one
SpectraBase Compound ID 2xmb0EUoSLA
InChI InChI=1S/C21H34O4/c1-4-5-6-7-8-9-17(22)19-16-12-21(11-15(16)10-18(19)23)24-13-20(2,3)14-25-21/h8-9,15-17,19,22H,4-7,10-14H2,1-3H3/b9-8+/t15?,16?,17-,19-/m0/s1
InChIKey HVOJNWLTUAKINW-MJULOJCISA-N
Mol Weight 350.5 g/mol
Molecular Formula C21H34O4
Exact Mass 350.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Osj2fkzrM
Name (1S*)-Tetrahydro-4'-(1"-hydroxy-2"-octenyl)-5,5-dimethylspiro[1,3-dioxane-2,2'-(1'H)-pentalen]-5'(3'H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34O4
InChI InChI=1S/C21H34O4/c1-4-5-6-7-8-9-17(22)19-16-12-21(11-15(16)10-18(19)23)24-13-20(2,3)14-25-21/h8-9,15-17,19,22H,4-7,10-14H2,1-3H3/b9-8+/t15?,16?,17-,19-/m0/s1
InChIKey HVOJNWLTUAKINW-MJULOJCISA-N
Molecular Weight 350.499 g/mol
SMILES O[C@]([C@]1(C(=O)CC2C1CC1(OCC(CO1)(C)C)C2)[H])(\C=C\CCCCC)[H]
SPLASH splash10-00bd-3910000000-2dada91bceefc2c058d7
Source of Spectrum U1-1998-815-29
Synonyms (1S*)-Tetrahydro-4'-(1''-hydroxy-2''-octenyl)-5,5-dimethylspiro[1,3-dioxane-2,2'-(1'H)-pentalen]-5'(3'H)-one (4'S)-4'-[(1S,2E)-1-hydroxyoct-2-en-1-yl]-5,5-dimethyl-hexahydro-1'H-spiro[1,3-dioxane-2,2'-pentalene]-5'-one
Wiley ID 751279