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(S)-(-)-Perillyl alcohol
SpectraBase Compound ID EmICk1EJUAH
InChI InChI=1S/C10H16O/c1-8(2)10-5-3-9(7-11)4-6-10/h3,10-11H,1,4-7H2,2H3/t10-/m1/s1
InChIKey NDTYTMIUWGWIMO-SNVBAGLBSA-N
Mol Weight 152.24 g/mol
Molecular Formula C10H16O
Exact Mass 152.120115 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID D6qLAPiUJiI
Name (S)-(-)-Perillyl alcohol
Acquisition Mode SIMULTANEOUS
CAS Registry Number 536-59-4; 18457-55-1
ChEBI ID 10782
Comments Saturated (s)-(-)-perillyl alcohol - Sigma-Aldrich Solvent CDCl3, temperature 298 K
Copyright Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved.
Data Source Madison Metabolomics Consortium
Formula C10 H16 O
IUPAC Name [(4S)-4-prop-1-en-2-yl-1-cyclohexenyl]methanol; [(4S)-4-isopropenyl-1-cyclohexenyl]methanol
InChI InChI=1S/C10H16O/c1-8(2)10-5-3-9(7-11)4-6-10/h3,10-11H,1,4-7H2,2H3/t10-/m1/s1
InChIKey NDTYTMIUWGWIMO-SNVBAGLBSA-N
KEGG Compound ID C02452
KEGG Pathways PATH: ko00902 Monoterpenoid biosynthesis PATH: ko00903 Limonene and pinene degradation
PubChem Compound ID 369312
SMILES CC(=C)C1CCC(=CC1)CO; CC(=C)[C@H]1CCC(=CC1)CO
Source File Reference bmse000559