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1,2,3,4,5,6-Hexahydro-6,11-dimethyl-3-(3-methyl-2-hydroxy-3-butenyl)-2,6-methano-3-benzazocin-8-ol
SpectraBase Compound ID 3iU8uefJiSW
InChI InChI=1S/C19H27NO2/c1-12(2)18(22)11-20-8-7-19(4)13(3)17(20)9-14-5-6-15(21)10-16(14)19/h5-6,10,13,17-18,21-22H,1,7-9,11H2,2-4H3/t13?,17-,18?,19-/m1/s1
InChIKey UKHADRBDZQWHOE-CIHDQMCQSA-N
Mol Weight 301.43 g/mol
Molecular Formula C19H27NO2
Exact Mass 301.204179 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5rS2AkKiBpd
Name 1,2,3,4,5,6-Hexahydro-6,11-dimethyl-3-(3-methyl-2-hydroxy-3-butenyl)-2,6-methano-3-benzazocin-8-ol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 301.204179111 u
Formula C19H27NO2
InChI InChI=1S/C19H27NO2/c1-12(2)18(22)11-20-8-7-19(4)13(3)17(20)9-14-5-6-15(21)10-16(14)19/h5-6,10,13,17-18,21-22H,1,7-9,11H2,2-4H3/t13?,17-,18?,19-/m1/s1
InChIKey UKHADRBDZQWHOE-CIHDQMCQSA-N
SMILES [C@@]12(C=3C(=CC=C(C3)O)C[C@](C1C)(N(CC2)CC(C(=C)C)O)[H])C