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(1R,2S,3'S,4R,6S,7S)-4-(3'-hydroxy-3'-phenylpropyl)-1,10,10-trimethyl-3,5-dioxatricyclo[3.2.1.0(2,6)]decane

View entire compound with spectra: 1 MS (GC)

(1R,2S,3'S,4R,6S,7S)-4-(3'-hydroxy-3'-phenylpropyl)-1,10,10-trimethyl-3,5-dioxatricyclo[3.2.1.0(2,6)]decane
SpectraBase Compound ID 4HyBSjnssGw
InChI InChI=1S/C20H28O3/c1-19(2)14-11-12-20(19,3)18-17(14)22-16(23-18)10-9-15(21)13-7-5-4-6-8-13/h4-8,14-18,21H,9-12H2,1-3H3/t14-,15?,16?,17-,18-,20+/m0/s1
InChIKey MSMRAKQXDGTWMT-HLQXUZJCSA-N
Mol Weight 316.44 g/mol
Molecular Formula C20H28O3
Exact Mass 316.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LGxiBoWVwx5
Name (1R,2S,3'S,4R,6S,7S)-4-(3'-hydroxy-3'-phenylpropyl)-1,10,10-trimethyl-3,5-dioxatricyclo[3.2.1.0(2,6)]decane
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Formula C20H28O3
InChI InChI=1S/C20H28O3/c1-19(2)14-11-12-20(19,3)18-17(14)22-16(23-18)10-9-15(21)13-7-5-4-6-8-13/h4-8,14-18,21H,9-12H2,1-3H3/t14-,15?,16?,17-,18-,20+/m0/s1
InChIKey MSMRAKQXDGTWMT-HLQXUZJCSA-N
Molecular Weight 316.441 g/mol
SMILES OC(CCC1O[C@@]2([C@@]3(C([C@@](CC3)([C@@]2(O1)[H])[H])(C)C)C)[H])c1ccccc1
SPLASH splash10-0005-0900000000-7d20d79d3e2c5891c304
Source of Spectrum QC-6-1793-11
Synonyms (3'S)-4-(3'-hydroxy-3'-phenylpropyl)-1,10,10-trimethyl-3,5-dioxatricyclo[3.2.1.0(2,6)]decane
Wiley ID 868962