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rel-(2R,7R,.alpha.S)-7-Methyl-.alpha.-(1-methylethyl)oxepane-2-methanol
SpectraBase Compound ID GSvZPzgHxW8
InChI InChI=1S/C11H22O2/c1-8(2)11(12)10-7-5-4-6-9(3)13-10/h8-12H,4-7H2,1-3H3/t9-,10-,11+/m1/s1
InChIKey QEPIRKIMNWVLNE-MXWKQRLJSA-N
Mol Weight 186.29 g/mol
Molecular Formula C11H22O2
Exact Mass 186.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5I9vDiO1lNw
Name rel-(2R,7R,.alpha.S)-7-Methyl-.alpha.-(1-methylethyl)oxepane-2-methanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H22O2
InChI InChI=1S/C11H22O2/c1-8(2)11(12)10-7-5-4-6-9(3)13-10/h8-12H,4-7H2,1-3H3/t9-,10-,11+/m1/s1
InChIKey QEPIRKIMNWVLNE-MXWKQRLJSA-N
Molecular Weight 186.295 g/mol
SMILES O[C@]([C@@]1(O[C@](C)(CCCC1)[H])[H])(C(C)C)[H]
SPLASH splash10-0007-5900000000-5dfc4dffaef3db147d58
Source of Spectrum J-56-4147-19
Synonyms (1S)-2-methyl-1-[(2R,7R)-7-methyloxepanyl]-1-propanol
Wiley ID 1183178