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3-butyl-1-methoxy-isoquinoline

View entire compound with spectra: 1 MS (GC)

3-butyl-1-methoxy-isoquinoline
SpectraBase Compound ID GyugjOLL3f7
InChI InChI=1S/C14H17NO/c1-3-4-8-12-10-11-7-5-6-9-13(11)14(15-12)16-2/h5-7,9-10H,3-4,8H2,1-2H3
InChIKey PGCUYDARMXCOCV-UHFFFAOYSA-N
Mol Weight 215.3 g/mol
Molecular Formula C14H17NO
Exact Mass 215.131014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DXaFw36lfCz
Name 3-butyl-1-methoxy-isoquinoline
Appearance Colorless oil
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 215.131014170 u
Formula C14H17NO
InChI InChI=1S/C14H17NO/c1-3-4-8-12-10-11-7-5-6-9-13(11)14(15-12)16-2/h5-7,9-10H,3-4,8H2,1-2H3
InChIKey PGCUYDARMXCOCV-UHFFFAOYSA-N
Instrument Name Finnigan MAT 8200
Ionization Type EI
Literature Reference DOI 10.1002/chem.201503403
Molecular Weight 215.296 g/mol
Quality 190
Reported Formula C14H17NO
SMILES C1=CC2=C(C=C1)C=C(N=C2OC)CCCC
SPLASH splash10-00di-0910000000-7183578c47a098badce2
Source of Spectrum QE-22-SM28-28-3 (DOI: 10.1002/chem.201503403)
Wiley ID 1902911