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(R)-3-Methyl-5-Phenylpent-4-ynol
SpectraBase Compound ID Fi9CkzlkNBK
InChI InChI=1S/C12H14O/c1-11(9-10-13)7-8-12-5-3-2-4-6-12/h2-6,11,13H,9-10H2,1H3/t11-/m0/s1
InChIKey YTENODTUTYBAIH-NSHDSACASA-N
Mol Weight 174.24 g/mol
Molecular Formula C12H14O
Exact Mass 174.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KogC1jsVLQO
Name (R)-3-Methyl-5-Phenylpent-4-ynol
Appearance Pale yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O
InChI InChI=1S/C12H14O/c1-11(9-10-13)7-8-12-5-3-2-4-6-12/h2-6,11,13H,9-10H2,1H3/t11-/m0/s1
InChIKey YTENODTUTYBAIH-NSHDSACASA-N
Ionization Type EI
Literature Reference DOI 10.1002/adsc.201900177
Molecular Weight 174.243 g/mol
Optical Rotation [a]D = -27.7 (c = 0.8, CH2Cl2)
SMILES OCC[C@](C#Cc1ccccc1)(C)[H]
SPLASH splash10-004i-0900000000-d9b617ffd6e456d88d19
Sample Comments 87% ee
Source of Spectrum ASC-361-2646-(R)-11a
Wiley ID 1836656