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11-Methoxy-9-cycloneren-3,7-diol
SpectraBase Compound ID 5pLHDvriN4F
InChI InChI=1S/C16H30O3/c1-12-13(8-11-15(12,4)17)16(5,18)10-7-9-14(2,3)19-6/h7,9,12-13,17-18H,8,10-11H2,1-6H3/b9-7+/t12-,13+,15+,16+/m0/s1
InChIKey MXWAVHJWKPMOSZ-IFOVSUQLSA-N
Mol Weight 270.41 g/mol
Molecular Formula C16H30O3
Exact Mass 270.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 90sTOIkpirV
Name 11-Methoxy-9-cycloneren-3,7-diol
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H30O3
InChI InChI=1S/C16H30O3/c1-12-13(8-11-15(12,4)17)16(5,18)10-7-9-14(2,3)19-6/h7,9,12-13,17-18H,8,10-11H2,1-6H3/b9-7+/t12-,13+,15+,16+/m0/s1
InChIKey MXWAVHJWKPMOSZ-IFOVSUQLSA-N
Instrument Name Autospec Premier P776
Ionization Type EI
Literature Reference DOI 10.1021/acs.jnatprod.8b00714
Molecular Weight 270.413 g/mol
Optical Rotation [a]D20 =-15 (c = 0.12, MeOH)
Reported Formula C16H30O3
SMILES O[C@]1([C@]([C@]([C@@](C\C=C\C(C)(C)OC)(O)C)(CC1)[H])(C)[H])C
SPLASH splash10-052f-9110000000-25b6b103ad3e237e3cdd
Source of Spectrum G4-81-2558-3
Wiley ID 1867652