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(3S,7S,8R,9S)-3-Benzyloxymethyl-8,10-isopropylidenedioxy-7,9-dimethyldecan-4-one
SpectraBase Compound ID AjxUQbiCqcM
InChI InChI=1S/C23H36O4/c1-6-20(16-25-15-19-10-8-7-9-11-19)21(24)13-12-17(2)22-18(3)14-26-23(4,5)27-22/h7-11,17-18,20,22H,6,12-16H2,1-5H3/t17-,18-,20-,22+/m0/s1
InChIKey KHWASXPLPDPVML-RJOZEALSSA-N
Mol Weight 376.5 g/mol
Molecular Formula C23H36O4
Exact Mass 376.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ATf9Yg00Ycl
Name (3S,7S,8R,9S)-3-Benzyloxymethyl-8,10-isopropylidenedioxy-7,9-dimethyldecan-4-one
Alternate Name(s) (3S,7S)-3-[(benzyloxy)methyl]-7-[(4R,5S)-2,2,5-trimethyl-1,3-dioxan-4-yl]-4-octanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H36O4
InChI InChI=1S/C23H36O4/c1-6-20(16-25-15-19-10-8-7-9-11-19)21(24)13-12-17(2)22-18(3)14-26-23(4,5)27-22/h7-11,17-18,20,22H,6,12-16H2,1-5H3/t17-,18-,20-,22+/m0/s1
InChIKey KHWASXPLPDPVML-RJOZEALSSA-N
Molecular Weight 376.537 g/mol
SMILES C1(O[C@@]([C@](CO1)(C)[H])([C@](CCC([C@](COCc1ccccc1)(CC)[H])=O)(C)[H])[H])(C)C
SPLASH splash10-0006-9200000000-c05a0d16338494f73d6e
Source of Spectrum E1-37-1700-10
Wiley ID 1517806