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(2R,3S)-2-[(benzoyloxy)methyl]-5-[(2R,5R)-1-hydroxy-2-methyl-5-(prop-1-en-2-yl)cyclohexyl]-6-oxooxan-3-yl benzoate
SpectraBase Compound ID jmErZ6mq1d
InChI InChI=1S/C30H34O7/c1-19(2)23-15-14-20(3)30(34,17-23)24-16-25(36-28(32)22-12-8-5-9-13-22)26(37-29(24)33)18-35-27(31)21-10-6-4-7-11-21/h4-13,20,23-26,34H,1,14-18H2,2-3H3/t20-,23-,24?,25+,26-,30+/m1/s1
InChIKey MWSSLBHCWSDPKW-BGODACBQSA-N
Mol Weight 506.6 g/mol
Molecular Formula C30H34O7
Exact Mass 506.230453 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BhH4SHDWbqV
Name (2R,3S)-2-[(benzoyloxy)methyl]-5-[(2R,5R)-1-hydroxy-2-methyl-5-(prop-1-en-2-yl)cyclohexyl]-6-oxooxan-3-yl benzoate
Alternate Name(s) 4,6-Di-O-Benzoyl-3-deoxy-D-arabino.delta.-lacetone and dihydrocarvone adduct
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H34O7
InChI InChI=1S/C30H34O7/c1-19(2)23-15-14-20(3)30(34,17-23)24-16-25(36-28(32)22-12-8-5-9-13-22)26(37-29(24)33)18-35-27(31)21-10-6-4-7-11-21/h4-13,20,23-26,34H,1,14-18H2,2-3H3/t20-,23-,24?,25+,26-,30+/m1/s1
InChIKey MWSSLBHCWSDPKW-BGODACBQSA-N
Molecular Weight 506.595 g/mol
SMILES O[C@@]1(C2C(O[C@@]([C@](C2)(OC(=O)c2ccccc2)[H])(COC(=O)c2ccccc2)[H])=O)C[C@](C(=C)C)(CC[C@]1(C)[H])[H]
SPLASH splash10-0a4i-1900000000-e5f07f6dacddec4b20eb
Source of Spectrum J-58-4068-21
Wiley ID 1399906