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[3R-(1E,3.alpha.,5.alpha.)]-[3-hydroxy-5-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-2-methylenecyclohexylidene]acetic acid ethyl ester

View entire compound with spectra: 1 MS (GC)

[3R-(1E,3.alpha.,5.alpha.)]-[3-hydroxy-5-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-2-methylenecyclohexylidene]acetic acid ethyl ester
SpectraBase Compound ID 9GaQHBLk2Tw
InChI InChI=1S/C17H30O4Si/c1-8-20-16(19)10-13-9-14(11-15(18)12(13)2)21-22(6,7)17(3,4)5/h10,14-15,18H,2,8-9,11H2,1,3-7H3/b13-10+/t14-,15-/m1/s1
InChIKey SAJHSZPKJLTCFH-RTZSPXFWSA-N
Mol Weight 326.51 g/mol
Molecular Formula C17H30O4Si
Exact Mass 326.191336 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6NNQznAvTUg
Name [3R-(1E,3.alpha.,5.alpha.)]-[3-hydroxy-5-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-2-methylenecyclohexylidene]acetic acid ethyl ester
Alternate Name(s) Ethyl (2E)-((3R,5R)-5-{[tert-butyl(dimethyl)silyl]oxy}-3-hydroxy-2-methylenecyclohexylidene)ethanoate
CAS Registry Number 123836-59-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H30O4Si
InChI InChI=1S/C17H30O4Si/c1-8-20-16(19)10-13-9-14(11-15(18)12(13)2)21-22(6,7)17(3,4)5/h10,14-15,18H,2,8-9,11H2,1,3-7H3/b13-10+/t14-,15-/m1/s1
InChIKey SAJHSZPKJLTCFH-RTZSPXFWSA-N
Molecular Weight 326.508 g/mol
SMILES O[C@]1(C(\C(=C\C(=O)OCC)C[C@](C1)(O[Si](C(C)(C)C)(C)C)[H])=C)[H]
SPLASH splash10-004i-9030000000-08aaa3d49d3865e28e8b
Source of Spectrum J-55-246-10
Wiley ID 1324684