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[4-(1,6-dihydroxy-1,5-dimethyl-hexyl)-3-hydroxy-phenyl]methyl acetate
SpectraBase Compound ID HUqxZHHwSwg
InChI InChI=1S/C17H26O5/c1-12(10-18)5-4-8-17(3,21)15-7-6-14(9-16(15)20)11-22-13(2)19/h6-7,9,12,18,20-21H,4-5,8,10-11H2,1-3H3
InChIKey QIMUAEOFGNMNCW-UHFFFAOYSA-N
Mol Weight 310.39 g/mol
Molecular Formula C17H26O5
Exact Mass 310.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6vTPNfuI9Ua
Name [4-(1,6-dihydroxy-1,5-dimethyl-hexyl)-3-hydroxy-phenyl]methyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26O5
InChI InChI=1S/C17H26O5/c1-12(10-18)5-4-8-17(3,21)15-7-6-14(9-16(15)20)11-22-13(2)19/h6-7,9,12,18,20-21H,4-5,8,10-11H2,1-3H3
InChIKey QIMUAEOFGNMNCW-UHFFFAOYSA-N
Molecular Weight 310.390 g/mol
SMILES Oc1c(C(CCCC(CO)C)(O)C)ccc(c1)COC(=O)C
SPLASH splash10-0a59-2091000000-602b8ef9902c682238fa
Source of Spectrum U-1993-568-3
Synonyms [4-(2,7-dihydroxy-6-methylheptan-2-yl)-3-hydroxyphenyl]methyl acetate [4-[6-methyl-2,7-bis(oxidanyl)heptan-2-yl]-3-oxidanyl-phenyl]methyl ethanoate Acetic acid [4-(2,7-dihydroxy-6-methylheptan-2-yl)-3-hydroxyphenyl]methyl ester
Wiley ID 765009