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Siphonarienal
SpectraBase Compound ID 4BLverKpaZg
InChI InChI=1S/C15H28O/c1-6-7-12(2)8-13(3)9-14(4)10-15(5)11-16/h10-14H,6-9H2,1-5H3/b15-10+/t12-,13-,14-/m0/s1
InChIKey HRYWLSLFUYLTSR-GHJWDUABSA-N
Mol Weight 224.39 g/mol
Molecular Formula C15H28O
Exact Mass 224.214016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6QaeofzXbJ4
Name Siphonarienal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 224.214015521 u
Formula C15H28O
InChI InChI=1S/C15H28O/c1-6-7-12(2)8-13(3)9-14(4)10-15(5)11-16/h10-14H,6-9H2,1-5H3/b15-10+/t12-,13-,14-/m0/s1
InChIKey HRYWLSLFUYLTSR-GHJWDUABSA-N
Instrument Name Finnigan MAT 95Q or Finnigan MAT 90 or JEOL JMS-700
Ionization Type EI
Literature Reference DOI 10.1002/anie.201800792
Molecular Weight 224.388 g/mol
Optical Rotation [a]D20 = 16.2 (c = 0.09, CHCl3)
Quality 226
Reported Formula C15H28O
SMILES [C@](C[C@@](C[C@](C)(\C=C\(C=O)C)[H])(C)[H])(CCC)(C)[H]
SPLASH splash10-02ta-9700000000-a443ceed0e293b6f6bea
Source of Spectrum ACI-57-SM101-7 (DOI: 10.1002/anie.201800792)
Wiley ID 1890732