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(S)-2-Methyl-5-Phenylpentan-1-ol
SpectraBase Compound ID 3sbimtnSmHy
InChI InChI=1S/C12H18O/c1-11(10-13)6-5-9-12-7-3-2-4-8-12/h2-4,7-8,11,13H,5-6,9-10H2,1H3/t11-/m0/s1
InChIKey DRTBYQJIHFSKDT-NSHDSACASA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8cLJuyRmeEX
Name (S)-2-Methyl-5-Phenylpentan-1-ol
Appearance Pale yellow oil
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-11(10-13)6-5-9-12-7-3-2-4-8-12/h2-4,7-8,11,13H,5-6,9-10H2,1H3/t11-/m0/s1
InChIKey DRTBYQJIHFSKDT-NSHDSACASA-N
Ionization Type EI
Literature Reference DOI 10.1002/adsc.201900177
Molecular Weight 178.275 g/mol
Optical Rotation [a]D = -9.8 (c = 1.4, EtOH)
SMILES OC[C@](CCCc1ccccc1)(C)[H]
SPLASH splash10-0udi-0900000000-6e143176b1841eb7e612
Sample Comments 90% ee
Source of Spectrum ASC-361-2646-(S)-14
Wiley ID 1836664