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N-Demethylmesembranol

View entire compound with spectra: 1 MS (GC)

N-Demethylmesembranol
SpectraBase Compound ID 6TfFkKDBLp
InChI InChI=1S/C16H23NO3/c1-19-13-4-3-11(9-14(13)20-2)16-6-5-12(18)10-15(16)17-8-7-16/h3-4,9,12,15,17-18H,5-8,10H2,1-2H3/t12-,15+,16+/m1/s1
InChIKey VIDCAYGUBRUNLE-KCXAZCMYSA-N
Mol Weight 277.36 g/mol
Molecular Formula C16H23NO3
Exact Mass 277.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GDeVKNvZptY
Name N-Demethylmesembranol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23NO3
InChI InChI=1S/C16H23NO3/c1-19-13-4-3-11(9-14(13)20-2)16-6-5-12(18)10-15(16)17-8-7-16/h3-4,9,12,15,17-18H,5-8,10H2,1-2H3/t12-,15+,16+/m1/s1
InChIKey VIDCAYGUBRUNLE-KCXAZCMYSA-N
Molecular Weight 277.364 g/mol
SMILES N1CC[C@@]2(CC[C@](C[C@]12[H])(O)[H])c1cc(OC)c(cc1)OC
SPLASH splash10-014i-9030000000-d743e9c1dc1709e89c56
Source of Spectrum F8-24-237-6
Wiley ID 1581592