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2-[2-(2,2-Dimethylpropanoyl)-1,2,3,4-tetrahydro-1-isoquinolinyl]-2-butanol
SpectraBase Compound ID 3LFSB0ZyZho
InChI InChI=1S/C18H27NO2/c1-6-18(5,21)15-14-10-8-7-9-13(14)11-12-19(15)16(20)17(2,3)4/h7-10,15,21H,6,11-12H2,1-5H3
InChIKey ZCNCFHGCCGKAIG-UHFFFAOYSA-N
Mol Weight 289.42 g/mol
Molecular Formula C18H27NO2
Exact Mass 289.204179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L5HPSVikJQK
Name 2-[2-(2,2-Dimethylpropanoyl)-1,2,3,4-tetrahydro-1-isoquinolinyl]-2-butanol
CAS Registry Number 114609-14-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H27NO2
InChI InChI=1S/C18H27NO2/c1-6-18(5,21)15-14-10-8-7-9-13(14)11-12-19(15)16(20)17(2,3)4/h7-10,15,21H,6,11-12H2,1-5H3
InChIKey ZCNCFHGCCGKAIG-UHFFFAOYSA-N
Molecular Weight 289.419 g/mol
SMILES OC(C1N(CCc2c1cccc2)C(=O)C(C)(C)C)(CC)C
SPLASH splash10-066r-9750000000-885ae06ae0c2dc153da8
Synonyms 1-[1-(1-hydroxy-1-methyl-propyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2,2-dimethyl-propan-1-one 1-[1-(2-hydroxybutan-2-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-2,2-dimethyl-1-propanone 1-[1-(2-hydroxybutan-2-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-2,2-dimethylpropan-1-one 2,2-Dimethyl-1-[1-(2-oxidanylbutan-2-yl)-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one
Wiley ID 1480656