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14-Dehydroxyethylidene-14a-(2-hydroxyethyl)-2,3-dihydro-zoapatanol
SpectraBase Compound ID 755duQ5XC3V
InChI InChI=1S/C20H38O4/c1-15(2)7-9-18(22)16(3)6-5-12-20(4)19(23)10-8-17(11-13-21)14-24-20/h15-17,19,21,23H,5-14H2,1-4H3
InChIKey BXKQYIKPTRBPOZ-UHFFFAOYSA-N
Mol Weight 342.5 g/mol
Molecular Formula C20H38O4
Exact Mass 342.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Iptcsc2qgql
Name 5-Nonanone, 1-[3-hydroxy-6-(2-hydroxyethyl)-2-methyl-2-oxepanyl]-4,8-dimethyl-
CAS Registry Number 68567-43-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H38O4
InChI InChI=1S/C20H38O4/c1-15(2)7-9-18(22)16(3)6-5-12-20(4)19(23)10-8-17(11-13-21)14-24-20/h15-17,19,21,23H,5-14H2,1-4H3
InChIKey BXKQYIKPTRBPOZ-UHFFFAOYSA-N
Molecular Weight 342.520 g/mol
SMILES OCCC1COC(C(CC1)O)(CCCC(C(=O)CCC(C)C)C)C
SPLASH splash10-0a4l-9000000000-fa445e11162afecfeb20
Source of Spectrum 0-16-282-1
Synonyms 1-[3-hydroxy-6-(2-hydroxyethyl)-2-methyl-2-oxepanyl]-4,8-dimethyl-5-nonanone 9-((2'S,3'R,6'R)-3'-hydroxy-6'-(2''-hydroxyethyl)-2'-methyl-2'-oxepanyl)-2,b-dimethylnonan-5-one 9-((2'S,3'R,6'R)-3'-hydroxy-6'-(2''-hydroxyethyl)-2'-methyl-2'-oxepanyl)-2,b-dimethylnonan-5-one Oxepane, 5-nonanone deriv.
Wiley ID 1336738