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6-epi-Mesembranol
SpectraBase Compound ID E3e1IHEXIaV
InChI InChI=1S/C17H25NO3/c1-18-9-8-17(7-6-13(19)11-16(17)18)12-4-5-14(20-2)15(10-12)21-3/h4-5,10,13,16,19H,6-9,11H2,1-3H3/t13-,16-,17-/m0/s1
InChIKey KPMLOZVRLWHOBN-JQFCIGGWSA-N
Mol Weight 291.39 g/mol
Molecular Formula C17H25NO3
Exact Mass 291.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 63HDbdVzZUH
Name Mesembranol
CAS Registry Number 23506-77-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H25NO3
InChI InChI=1S/C17H25NO3/c1-18-9-8-17(7-6-13(19)11-16(17)18)12-4-5-14(20-2)15(10-12)21-3/h4-5,10,13,16,19H,6-9,11H2,1-3H3/t13-,16-,17-/m0/s1
InChIKey KPMLOZVRLWHOBN-JQFCIGGWSA-N
Molecular Weight 291.391 g/mol
SMILES O[C@]1(CC[C@@]2([C@@](N(C)CC2)(C1)[H])c1cc(OC)c(cc1)OC)[H]
SPLASH splash10-0006-1090000000-a93466e9e47d262289aa
Source of Spectrum O-11-8-3
Wiley ID 1294632