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(3S)-3-(Hydroxymethyl)-N-(3'-pentynyl)-1,2,3,4-tetrahydro-isoquinoline
SpectraBase Compound ID Bem5HpucsiI
InChI InChI=1S/C15H19NO/c1-2-3-6-9-16-11-14-8-5-4-7-13(14)10-15(16)12-17/h4-5,7-8,15,17H,6,9-12H2,1H3/t15-/m0/s1
InChIKey NFWMDLLAAKEDOG-HNNXBMFYSA-N
Mol Weight 229.32 g/mol
Molecular Formula C15H19NO
Exact Mass 229.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9vgmP2zH9pE
Name (3S)-3-(Hydroxymethyl)-N-(3'-pentynyl)-1,2,3,4-tetrahydro-isoquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19NO
InChI InChI=1S/C15H19NO/c1-2-3-6-9-16-11-14-8-5-4-7-13(14)10-15(16)12-17/h4-5,7-8,15,17H,6,9-12H2,1H3/t15-/m0/s1
InChIKey NFWMDLLAAKEDOG-HNNXBMFYSA-N
Molecular Weight 229.323 g/mol
SMILES OC[C@]1(N(Cc2ccccc2C1)CCC#CC)[H]
SPLASH splash10-002b-0900000000-0f0f4cc415d2defae7f2
Source of Spectrum F5-3-2856-14
Synonyms (S)-(2-(pent-3-yn-1-yl)-1,2,3,4-tetrahydroisoquinolin-3-yl)methanol
Wiley ID 1732428