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(1R,3R)-1,3-dimethyl-2-(phenylmethyl)-8-propan-2-yloxy-3,4-dihydro-1H-isoquinolin-6-ol
SpectraBase Compound ID JqqXstHhXVa
InChI InChI=1S/C21H27NO2/c1-14(2)24-20-12-19(23)11-18-10-15(3)22(16(4)21(18)20)13-17-8-6-5-7-9-17/h5-9,11-12,14-16,23H,10,13H2,1-4H3/t15-,16-/m1/s1
InChIKey JOHFWRJBSSHQHK-HZPDHXFCSA-N
Mol Weight 325.45 g/mol
Molecular Formula C21H27NO2
Exact Mass 325.204179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1LdEIncdNT0
Name (1R,3R)-1,3-dimethyl-2-(phenylmethyl)-8-propan-2-yloxy-3,4-dihydro-1H-isoquinolin-6-ol
Alternate Name(s) (1R,3R)-2-benzyl-1,3-dimethyl-8-propan-2-yloxy-3,4-dihydro-1H-isoquinolin-6-ol (1R,3R)-2-benzyl-8-isopropoxy-1,3-dimethyl-3,4-dihydro-1H-isoquinolin-6-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H27NO2
InChI InChI=1S/C21H27NO2/c1-14(2)24-20-12-19(23)11-18-10-15(3)22(16(4)21(18)20)13-17-8-6-5-7-9-17/h5-9,11-12,14-16,23H,10,13H2,1-4H3/t15-,16-/m1/s1
InChIKey JOHFWRJBSSHQHK-HZPDHXFCSA-N
Molecular Weight 325.452 g/mol
SMILES Oc1cc2C[C@](N([C@@](c2c(c1)OC(C)C)(C)[H])Cc1ccccc1)(C)[H]
SPLASH splash10-03dl-7029000000-89ccb994e9ebf24afd81
Source of Spectrum F-54-505-17
Wiley ID 805366