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1-o-Tolylpent-4-en-2-ol
SpectraBase Compound ID KFlji1YKFxm
InChI InChI=1S/C12H16O/c1-3-6-12(13)9-11-8-5-4-7-10(11)2/h3-5,7-8,12-13H,1,6,9H2,2H3
InChIKey NFLSHBUWCFHFOW-UHFFFAOYSA-N
Mol Weight 176.26 g/mol
Molecular Formula C12H16O
Exact Mass 176.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID InUckX3TD5v
Name 1-o-Tolylpent-4-en-2-ol
Alternate Name(s) 1-(o-tolyl)pent-4-en-2-ol 1-(2-Methylphenyl)-4-penten-2-ol 1-(2-Methylphenyl)pent-4-en-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O
InChI InChI=1S/C12H16O/c1-3-6-12(13)9-11-8-5-4-7-10(11)2/h3-5,7-8,12-13H,1,6,9H2,2H3
InChIKey NFLSHBUWCFHFOW-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo302572s
Molecular Weight 176.259 g/mol
SMILES OC(Cc1c(cccc1)C)CC=C
SPLASH splash10-0a4i-0900000000-3fcaa28b22e0fceca7c1
Source of Spectrum J-78-1280-2d
Wiley ID 1745404