SpectraBase Compound ID | AFovpIGOW5z |
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InChI | InChI=1S/C11H12O/c1-2-11(12)9-8-10-6-4-3-5-7-10/h3-7,11-12H,2H2,1H3/t11-/m0/s1 |
InChIKey | QWCMSASONHVIHV-NSHDSACASA-N |
Mol Weight | 160.22 g/mol |
Molecular Formula | C11H12O |
Exact Mass | 160.088815 g/mol |
SpectraBase Spectrum ID | 64Ios7LBKBH |
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Name | (3S)-1-Phenyl-1-pentyn-3-ol |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 160.088815005 u |
Formula | C11H12O |
InChI | InChI=1S/C11H12O/c1-2-11(12)9-8-10-6-4-3-5-7-10/h3-7,11-12H,2H2,1H3/t11-/m0/s1 |
InChIKey | QWCMSASONHVIHV-NSHDSACASA-N |
Molecular Weight | 160.216 g/mol |
SMILES | C(#C[C@@](O)(CC)[H])C=1C=CC=CC1 |