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(3S,6S)-6-tert-Butyldimethylsilyloxy-7,7-dimethyl-3-[(1S,2R)-2-methyl-3-oxocyclopentyl]oxepan-2-one
SpectraBase Compound ID HSTJw3qXcex
InChI InChI=1S/C20H36O4Si/c1-13-14(9-11-16(13)21)15-10-12-17(20(5,6)23-18(15)22)24-25(7,8)19(2,3)4/h13-15,17H,9-12H2,1-8H3/t13-,14+,15+,17+/m1/s1
InChIKey JNXFITMVSBUQLE-AESZEHBQSA-N
Mol Weight 368.6 g/mol
Molecular Formula C20H36O4Si
Exact Mass 368.238286 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3wDTpjy96O
Name (3S,6S)-6-tert-Butyldimethylsilyloxy-7,7-dimethyl-3-[(1S,2R)-2-methyl-3-oxocyclopentyl]oxepan-2-one
Alternate Name(s) (3S,6S)-6-{[tert-butyl(dimethyl)silyl]oxy}-7,7-dimethyl-3-[(1S,2R)-2-methyl-3-oxocyclopentyl]-2-oxepanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H36O4Si
InChI InChI=1S/C20H36O4Si/c1-13-14(9-11-16(13)21)15-10-12-17(20(5,6)23-18(15)22)24-25(7,8)19(2,3)4/h13-15,17H,9-12H2,1-8H3/t13-,14+,15+,17+/m1/s1
InChIKey JNXFITMVSBUQLE-AESZEHBQSA-N
Molecular Weight 368.589 g/mol
SMILES C1(OC([C@@](O[Si](C(C)(C)C)(C)C)(CC[C@]1([C@@]1([C@](C(=O)CC1)(C)[H])[H])[H])[H])(C)C)=O
SPLASH splash10-0i2a-9573000000-120305ee782759d8bb97
Source of Spectrum K1-2004-795-42
Wiley ID 1560444