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1H-Indol-6-ol, octahydro-3a-(4-hydroxy-3-methoxyphenyl)-1-methyl-, [3aS-(3a.alpha.,6.beta.,7a.alpha.)]-
SpectraBase Compound ID 3TzoyNy1Q5X
InChI InChI=1S/C16H23NO3/c1-17-8-7-16(6-5-12(18)10-15(16)17)11-3-4-13(19)14(9-11)20-2/h3-4,9,12,15,18-19H,5-8,10H2,1-2H3/t12-,15-,16+/m1/s1
InChIKey HFIOZTPJJNPXGP-WQVCFCJDSA-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 8oZGeO1uNe8
Name 1H-Indol-6-ol, octahydro-3a-(4-hydroxy-3-methoxyphenyl)-1-methyl-, [3aS-(3a.alpha.,6.beta.,7a.alpha.)]-
CAS Registry Number 59096-16-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23NO3
InChI InChI=1S/C16H23NO3/c1-17-8-7-16(6-5-12(18)10-15(16)17)11-3-4-13(19)14(9-11)20-2/h3-4,9,12,15,18-19H,5-8,10H2,1-2H3/t12-,15-,16+/m1/s1
InChIKey HFIOZTPJJNPXGP-WQVCFCJDSA-N
Molecular Weight 277.364 g/mol
SMILES O[C@]1(C[C@@]2([C@](c3ccc(c(c3)OC)O)(CCN2C)CC1)[H])[H]
SPLASH splash10-0kk9-2190000000-b4496012335e8b611b6c
Source of Spectrum O-11-8-3
Synonyms (3aS,6R,7aR)-3a-(4-hydroxy-3-methoxyphenyl)-1-methyloctahydro-1H-indol-6-ol 4'-O-demethylmesembranol
Wiley ID 1281079