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(RS)-1-(p-Tolyl)-1-pentyn-3-ol

View entire compound with spectra: 1 MS (GC)

(RS)-1-(p-Tolyl)-1-pentyn-3-ol
SpectraBase Compound ID A52HsicXBGs
InChI InChI=1S/C12H14O/c1-3-12(13)9-8-11-6-4-10(2)5-7-11/h4-7,12-13H,3H2,1-2H3/t12-/m1/s1
InChIKey CPHZFKQTWUHGLL-GFCCVEGCSA-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 52eps5jBj6
Name (RS)-1-(p-Tolyl)-1-pentyn-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O
InChI InChI=1S/C12H14O/c1-3-12(13)9-8-11-6-4-10(2)5-7-11/h4-7,12-13H,3H2,1-2H3/t12-/m1/s1
InChIKey CPHZFKQTWUHGLL-GFCCVEGCSA-N
Molecular Weight 174.243 g/mol
SMILES O[C@@](C#Cc1ccc(cc1)C)(CC)[H]
SPLASH splash10-00kf-1900000000-6381647bf83231c9bc3b
Source of Spectrum QC-10-1169-2
Synonyms 1-(4-Methylphenyl)-1-pentyn-3-ol (3R)-1-(4-methylphenyl)-1-pentyn-3-ol (3R)-1-(4-methylphenyl)pent-1-yn-3-ol
Wiley ID 871208