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2-Methyl-4a.alpha.-(3-methoxyphenyl)-2,3,4,4a,5,6,7,8-octahydro-6.alpha.-isoquinolinol acetate
SpectraBase Compound ID 55s9aadVKjF
InChI InChI=1S/C19H25NO3/c1-14(21)23-18-17-9-4-5-10-19(17,11-12-20(18)2)15-7-6-8-16(13-15)22-3/h6-8,13H,4-5,9-12H2,1-3H3/t19-/m1/s1
InChIKey ZVJQQMMJHQKUPG-LJQANCHMSA-N
Mol Weight 315.41 g/mol
Molecular Formula C19H25NO3
Exact Mass 315.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7xazfvBolLo
Name 2-Methyl-4a.alpha.-(3-methoxyphenyl)-2,3,4,4a,5,6,7,8-octahydro-6.alpha.-isoquinolinol acetate
Alternate Name(s) (4aR)-4a-(3-methoxyphenyl)-2-methyl-2,3,4,4a,5,6,7,8-octahydro-1-isoquinolinyl acetate
CAS Registry Number 118724-82-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H25NO3
InChI InChI=1S/C19H25NO3/c1-14(21)23-18-17-9-4-5-10-19(17,11-12-20(18)2)15-7-6-8-16(13-15)22-3/h6-8,13H,4-5,9-12H2,1-3H3/t19-/m1/s1
InChIKey ZVJQQMMJHQKUPG-LJQANCHMSA-N
Molecular Weight 315.413 g/mol
SMILES C1(=C2[C@](c3cc(OC)ccc3)(CCCC2)CCN1C)OC(=O)C
SPLASH splash10-066s-0889000000-b9bc32c3196671e31cd4
Source of Spectrum J-54-1444-18
Wiley ID 1316116