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2-Formyl-1-(3-hydroxypropyl)-1,2,3,4-tetrahydroisoquinoline

View entire compound with spectra: 1 MS (GC)

2-Formyl-1-(3-hydroxypropyl)-1,2,3,4-tetrahydroisoquinoline
SpectraBase Compound ID Dg8AfUjDCDb
InChI InChI=1S/C13H17NO2/c15-9-3-6-13-12-5-2-1-4-11(12)7-8-14(13)10-16/h1-2,4-5,10,13,15H,3,6-9H2
InChIKey CSMFXUAIIYGEGN-UHFFFAOYSA-N
Mol Weight 219.28 g/mol
Molecular Formula C13H17NO2
Exact Mass 219.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2TJ8HUW8DB9
Name 2-Formyl-1-(3-hydroxypropyl)-1,2,3,4-tetrahydroisoquinoline
Alternate Name(s) 1-(3-hydroxypropyl)-3,4-dihydro-1H-isoquinoline-2-carboxaldehyde 1-(3-oxidanylpropyl)-3,4-dihydro-1H-isoquinoline-2-carbaldehyde
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO2
InChI InChI=1S/C13H17NO2/c15-9-3-6-13-12-5-2-1-4-11(12)7-8-14(13)10-16/h1-2,4-5,10,13,15H,3,6-9H2
InChIKey CSMFXUAIIYGEGN-UHFFFAOYSA-N
Molecular Weight 219.284 g/mol
SMILES OCCCC1N(C=O)CCc2ccccc12
SPLASH splash10-03di-0900000000-2f6ab7c089440cacc8d7
Source of Spectrum F2-44-4040-10l
Wiley ID 1706021