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(6S)-2,6,10-Trimethyl-3-acetoxy-6-hydroxy-11-chloro-9E-undecaen-4-yne
SpectraBase Compound ID FDd4hoe4t4D
InChI InChI=1S/C16H25ClO3/c1-12(2)15(20-14(4)18)8-10-16(5,19)9-6-7-13(3)11-17/h7,12,15,19H,6,9,11H2,1-5H3/b13-7+/t15?,16-/m0/s1
InChIKey IEGGORZRTAKUFH-XBKAESDYSA-N
Mol Weight 300.83 g/mol
Molecular Formula C16H25ClO3
Exact Mass 300.149222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F4QVB3Xaf33
Name (6S)-2,6,10-Trimethyl-3-acetoxy-6-hydroxy-11-chloro-9E-undecaen-4-yne
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H25ClO3
InChI InChI=1S/C16H25ClO3/c1-12(2)15(20-14(4)18)8-10-16(5,19)9-6-7-13(3)11-17/h7,12,15,19H,6,9,11H2,1-5H3/b13-7+/t15?,16-/m0/s1
InChIKey IEGGORZRTAKUFH-XBKAESDYSA-N
Molecular Weight 300.826 g/mol
SMILES O[C@](C#CC(OC(=O)C)C(C)C)(CC\C=C\(CCl)C)C
SPLASH splash10-0006-9220000000-e6ee34a01eeb304dd358
Source of Spectrum QA-42-705-19
Wiley ID 861986