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(5S)-Methyl .delta-butyryloxy-.delta.-(o-bromophenyl)-.beta.-oxo-pentanoate
SpectraBase Compound ID 6CvkVtPGYdZ
InChI InChI=1S/C16H19BrO5/c1-3-6-15(19)22-14(9-11(18)10-16(20)21-2)12-7-4-5-8-13(12)17/h4-5,7-8,14H,3,6,9-10H2,1-2H3/t14-/m0/s1
InChIKey RXTRUASTIDWDQG-AWEZNQCLSA-N
Mol Weight 371.23 g/mol
Molecular Formula C16H19BrO5
Exact Mass 370.041587 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1kfsOreavSJ
Name (5S)-Methyl .delta-butyryloxy-.delta.-(o-bromophenyl)-.beta.-oxo-pentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19BrO5
InChI InChI=1S/C16H19BrO5/c1-3-6-15(19)22-14(9-11(18)10-16(20)21-2)12-7-4-5-8-13(12)17/h4-5,7-8,14H,3,6,9-10H2,1-2H3/t14-/m0/s1
InChIKey RXTRUASTIDWDQG-AWEZNQCLSA-N
Molecular Weight 371.227 g/mol
SMILES [C@](c1c(Br)cccc1)(CC(CC(=O)OC)=O)(OC(=O)CCC)[H]
SPLASH splash10-0uk9-8490000000-ef3b9905325fb06cfc17
Source of Spectrum KC-61-2179-8
Wiley ID 1628015