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4-[2-(1-Isoquinolinyl)ethyl]phenol
SpectraBase Compound ID JPAb2jWRpc3
InChI InChI=1S/C17H15NO/c19-15-8-5-13(6-9-15)7-10-17-16-4-2-1-3-14(16)11-12-18-17/h1-6,8-9,11-12,19H,7,10H2
InChIKey YURRWYHJQMHUMQ-UHFFFAOYSA-N
Mol Weight 249.31 g/mol
Molecular Formula C17H15NO
Exact Mass 249.115364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IVud9cCa8Jm
Name 4-[2-(1-Isoquinolinyl)ethyl]phenol
CAS Registry Number 78744-89-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15NO
InChI InChI=1S/C17H15NO/c19-15-8-5-13(6-9-15)7-10-17-16-4-2-1-3-14(16)11-12-18-17/h1-6,8-9,11-12,19H,7,10H2
InChIKey YURRWYHJQMHUMQ-UHFFFAOYSA-N
Molecular Weight 249.313 g/mol
SMILES Oc1ccc(cc1)CCc1c2ccccc2ccn1
SPLASH splash10-0002-0980000000-27628adff972fdfdc073
Source of Spectrum W5-1989-36125-29411
Synonyms 1-(4-Hydroxyphenethyl)isoquinoline 4-(2-isoquinolin-1-ylethyl)phenol 4-[2-(1-Isoquinolyl)ethyl]phenol
Wiley ID 1252450