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(trans)-Sobreryl diacetate
SpectraBase Compound ID C3sfmJUucRd
InChI InChI=1S/C14H22O4/c1-4-13(15)17-9-11-7-6-10(3)12(8-11)18-14(16)5-2/h6,11-12H,4-5,7-9H2,1-3H3/t11-,12+/m0/s1
InChIKey VEGYCZMRXLDTNK-NWDGAFQWSA-N
Mol Weight 254.33 g/mol
Molecular Formula C14H22O4
Exact Mass 254.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GGIbgyXt81Z
Name (trans)-Sobreryl diacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O4
InChI InChI=1S/C14H22O4/c1-4-13(15)17-9-11-7-6-10(3)12(8-11)18-14(16)5-2/h6,11-12H,4-5,7-9H2,1-3H3/t11-,12+/m0/s1
InChIKey VEGYCZMRXLDTNK-NWDGAFQWSA-N
Molecular Weight 254.326 g/mol
SMILES [C@]1(C(=CC[C@@](C1)(COC(=O)CC)[H])C)(OC(=O)CC)[H]
SPLASH splash10-014i-2900000000-450afc5af5ef0b75087f
Source of Spectrum G-57-1728-0
Synonyms (trans)-.alpha.,.alpha.,4-Trimethyl-3-cyclohexene-5-hydroxy-1-methanol 1,5-diacetate [(1S,5R)-4-methyl-5-(propionyloxy)-3-cyclohexen-1-yl]methyl propionate
Wiley ID 748602