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1-(2,5-Diacetoxyphenyl)-6-acetoxy-3,7-dimethyloctan-7-ol
SpectraBase Compound ID JZ54KR5TA3L
InChI InChI=1S/C22H32O7/c1-14(8-12-21(22(5,6)26)29-17(4)25)7-9-18-13-19(27-15(2)23)10-11-20(18)28-16(3)24/h10-11,13-14,21,26H,7-9,12H2,1-6H3
InChIKey LKGUGSXTDIRRCB-UHFFFAOYSA-N
Mol Weight 408.5 g/mol
Molecular Formula C22H32O7
Exact Mass 408.214803 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GBJvh0zBF6P
Name 1-(2,5-Diacetoxyphenyl)-6-acetoxy-3,7-dimethyloctan-7-ol
Alternate Name(s) 4-(acetyloxy)-2-[6-(acetyloxy)-7-hydroxy-3,7-dimethyloctyl]phenyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O7
InChI InChI=1S/C22H32O7/c1-14(8-12-21(22(5,6)26)29-17(4)25)7-9-18-13-19(27-15(2)23)10-11-20(18)28-16(3)24/h10-11,13-14,21,26H,7-9,12H2,1-6H3
InChIKey LKGUGSXTDIRRCB-UHFFFAOYSA-N
Molecular Weight 408.491 g/mol
SMILES OC(C(OC(=O)C)CCC(CCc1c(OC(=O)C)ccc(OC(=O)C)c1)C)(C)C
SPLASH splash10-00di-0961000000-1e09a00943c19537928c
Source of Spectrum F-50-10375-6
Wiley ID 789222