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Benzenepropanol, .gamma.-ethoxy-.beta.-methyl-, (R*,S*)-
SpectraBase Compound ID IGRmLAQe3o4
InChI InChI=1S/C12H18O2/c1-3-14-12(10(2)9-13)11-7-5-4-6-8-11/h4-8,10,12-13H,3,9H2,1-2H3/t10-,12+/m0/s1
InChIKey MOLWGXNXYDQXBN-CMPLNLGQSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C1eXG437kzS
Name Benzenepropanol, .gamma.-ethoxy-.beta.-methyl-, (R*,S*)-
Alternate Name(s) (2S,3R)-3-ethoxy-2-methyl-3-phenyl-1-propanol Erythro-2-methyl-3-ethoxy-3-phenylpropan-1-ol
CAS Registry Number 111160-20-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-3-14-12(10(2)9-13)11-7-5-4-6-8-11/h4-8,10,12-13H,3,9H2,1-2H3/t10-,12+/m0/s1
InChIKey MOLWGXNXYDQXBN-CMPLNLGQSA-N
Molecular Weight 194.274 g/mol
SMILES OC[C@@]([C@](c1ccccc1)(OCC)[H])(C)[H]
SPLASH splash10-0550-4900000000-9a76ccbc09dc0c2188c9
Source of Spectrum J-52-5703-10
Wiley ID 1191135