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1-Isoquinolinemethanol, .alpha.-(2-bromophenyl)-1,2,3,4-tetrahydro-, (R*,S*)-(.+-.)-
SpectraBase Compound ID 2dfJpp0mEjH
InChI InChI=1S/C16H16BrNO/c17-14-8-4-3-7-13(14)16(19)15-12-6-2-1-5-11(12)9-10-18-15/h1-8,15-16,18-19H,9-10H2/t15-,16+/m0/s1
InChIKey AFQYBWQIFAKHQG-JKSUJKDBSA-N
Mol Weight 318.21 g/mol
Molecular Formula C16H16BrNO
Exact Mass 317.041527 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GWSvH4JJ9DS
Name 1-Isoquinolinemethanol, .alpha.-(2-bromophenyl)-1,2,3,4-tetrahydro-, (R*,S*)-(.+-.)-
CAS Registry Number 114608-89-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16BrNO
InChI InChI=1S/C16H16BrNO/c17-14-8-4-3-7-13(14)16(19)15-12-6-2-1-5-11(12)9-10-18-15/h1-8,15-16,18-19H,9-10H2/t15-,16+/m0/s1
InChIKey AFQYBWQIFAKHQG-JKSUJKDBSA-N
Molecular Weight 318.214 g/mol
SMILES O[C@@]([C@@]1(c2c(cccc2)CCN1)[H])(c1c(Br)cccc1)[H]
SPLASH splash10-001i-2900000000-fc90b0b06df3d5d92d65
Source of Spectrum H-70-1374-0
Synonyms (R)-(2-bromophenyl)[(1S)-1,2,3,4-tetrahydro-1-isoquinolinyl]methanol U-2-bromo-.alpha.-(1,2,3,4-tetrahydro-1-isochinolinyl)benzyl-alcohol
Wiley ID 1317609