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1-[1-(1-Hydroxy-1-phenylethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2,2-dimethylpropan-1-one

View entire compound with spectra: 1 FTIR, and 3 MS (GC)

1-[1-(1-Hydroxy-1-phenylethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2,2-dimethylpropan-1-one
SpectraBase Compound ID 1994lkz14Xl
InChI InChI=1S/C22H27NO2/c1-21(2,3)20(24)23-15-14-16-10-8-9-13-18(16)19(23)22(4,25)17-11-6-5-7-12-17/h5-13,19,25H,14-15H2,1-4H3
InChIKey LHDKZANETALIBQ-UHFFFAOYSA-N
Mol Weight 337.46 g/mol
Molecular Formula C22H27NO2
Exact Mass 337.204179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4pFdFvG4b7c
Name 1-[1-(1-hydroxy-1-phenylethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2,2-dimethyl-1-propanone
CAS Registry Number 114609-13-1
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H27NO2
InChI InChI=1S/C22H27NO2/c1-21(2,3)20(24)23-15-14-16-10-8-9-13-18(16)19(23)22(4,25)17-11-6-5-7-12-17/h5-13,19,25H,14-15H2,1-4H3
InChIKey LHDKZANETALIBQ-UHFFFAOYSA-N
Molecular Weight 337.463 g/mol
SMILES OC(C1c2ccccc2CCN1C(=O)C(C)(C)C)(C)c1ccccc1
SPLASH splash10-0aor-9730000000-a93c619bae9bbc3a734b
Synonyms 1-[2-(2,2-Dimethylpropanoyl)-1,2,3,4-tetrahydro-1-isoquinolinyl]-1-phenylethanol 1-[1-(1-Hydroxy-1-phenylethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2,2-dimethylpropan-1-one 2,2-Dimethyl-1-[1-(1-oxidanyl-1-phenyl-ethyl)-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one
Wiley ID 1484645