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(S)-(-)-6-Benzoyloxy-7-oxoheptyl pivalate
SpectraBase Compound ID Frtk0mnhpK3
InChI InChI=1S/C19H26O5/c1-19(2,3)18(22)23-13-9-5-8-12-16(14-20)24-17(21)15-10-6-4-7-11-15/h4,6-7,10-11,14,16H,5,8-9,12-13H2,1-3H3/t16-/m0/s1
InChIKey GBBNNBJGGNTLST-INIZCTEOSA-N
Mol Weight 334.41 g/mol
Molecular Formula C19H26O5
Exact Mass 334.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3rEfKV82sIb
Name (S)-(-)-6-Benzoyloxy-7-oxoheptyl pivalate
Alternate Name(s) (1S)-6-[(2,2-dimethylpropanoyl)oxy]-1-formylhexyl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O5
InChI InChI=1S/C19H26O5/c1-19(2,3)18(22)23-13-9-5-8-12-16(14-20)24-17(21)15-10-6-4-7-11-15/h4,6-7,10-11,14,16H,5,8-9,12-13H2,1-3H3/t16-/m0/s1
InChIKey GBBNNBJGGNTLST-INIZCTEOSA-N
Molecular Weight 334.412 g/mol
SMILES C(O[C@](C=O)(CCCCCOC(C(C)(C)C)=O)[H])(=O)c1ccccc1
SPLASH splash10-0a4i-3900000000-6d7e31411a428939db91
Source of Spectrum QC-8-791-2
Wiley ID 869789