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(3S*,6S*)-6-Heptyl-4-(propan-2-ylidene)oxan-3-ol
SpectraBase Compound ID ESmBU1rXWZF
InChI InChI=1S/C15H28O2/c1-4-5-6-7-8-9-13-10-14(12(2)3)15(16)11-17-13/h13,15-16H,4-11H2,1-3H3/t13-,15+/m0/s1
InChIKey ICBOWVULSYPPHC-DZGCQCFKSA-N
Mol Weight 240.39 g/mol
Molecular Formula C15H28O2
Exact Mass 240.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G5sTGsu8j9G
Name (3S*,6S*)-6-Heptyl-4-(propan-2-ylidene)oxan-3-ol
Alternate Name(s) (3S,6S)-6-heptyl-4-(propan-2-ylidene)tetrahydro-2H-pyran-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H28O2
InChI InChI=1S/C15H28O2/c1-4-5-6-7-8-9-13-10-14(12(2)3)15(16)11-17-13/h13,15-16H,4-11H2,1-3H3/t13-,15+/m0/s1
InChIKey ICBOWVULSYPPHC-DZGCQCFKSA-N
Literature Reference DOI 10.1002/anie.201205913
Molecular Weight 240.387 g/mol
SMILES O[C@@]1(CO[C@@](CCCCCCC)(CC1=C(C)C)[H])[H]
SPLASH splash10-05o1-9200000000-dc603929672ef9161f33
Source of Spectrum ACI-51-SMS-30-10a
Wiley ID 1780772