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2-Ethyl-3-hydroxy-pentyl benzoate
SpectraBase Compound ID 61PpPckMKDe
InChI InChI=1S/C14H20O3/c1-3-11(13(15)4-2)10-17-14(16)12-8-6-5-7-9-12/h5-9,11,13,15H,3-4,10H2,1-2H3/t11-,13+/m0/s1
InChIKey BUYMLBFHHSSLTG-WCQYABFASA-N
Mol Weight 236.31 g/mol
Molecular Formula C14H20O3
Exact Mass 236.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 94AH2goa2Nk
Name 2-Ethyl-3-hydroxy-pentyl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O3
InChI InChI=1S/C14H20O3/c1-3-11(13(15)4-2)10-17-14(16)12-8-6-5-7-9-12/h5-9,11,13,15H,3-4,10H2,1-2H3/t11-,13+/m0/s1
InChIKey BUYMLBFHHSSLTG-WCQYABFASA-N
Literature Reference DOI 10.1021/ol802651b
Molecular Weight 236.311 g/mol
SMILES O[C@@]([C@@](CC)(COC(c1ccccc1)=O)[H])(CC)[H]
SPLASH splash10-00rb-5490000000-2563366e7ce94eb57e68
Source of Spectrum A1-11-165/SMS11-5'
Synonyms (2S,3R)-2-ethyl-3-hydroxypentyl benzoate
Wiley ID 1756524