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2-(4-methyltetrahydropyran-2-yl)-3,4-dihydro-1H-isoquinoline(Autogenerated)
SpectraBase Compound ID JNmgJpLKrT8
InChI InChI=1S/C15H21NO/c1-12-7-9-17-15(10-12)16-8-6-13-4-2-3-5-14(13)11-16/h2-5,12,15H,6-11H2,1H3
InChIKey QVKXIHQGXIIXTC-UHFFFAOYSA-N
Mol Weight 231.34 g/mol
Molecular Formula C15H21NO
Exact Mass 231.162314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C4Xhp1XDovj
Name 2-(4-methyltetrahydropyran-2-yl)-3,4-dihydro-1H-isoquinoline(Autogenerated)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 231.162314299 u
Formula C15H21NO
InChI InChI=1S/C15H21NO/c1-12-7-9-17-15(10-12)16-8-6-13-4-2-3-5-14(13)11-16/h2-5,12,15H,6-11H2,1H3
InChIKey QVKXIHQGXIIXTC-UHFFFAOYSA-N
Instrument Name Shimadzu QP2010-PLUS
Ionization Type EI
Literature Reference DOI 10.1002/cctc.202201113
Molecular Weight 231.339 g/mol
Quality 327
SMILES C1=CC2=C(C=C1)CCN(C2)C1OCCC(C1)C
SPLASH splash10-0002-0900000000-85b6cb2f56275d504876
Source of Spectrum CCC-15-SM4-11 (DOI: 10.1002/cctc.202201113)
Wiley ID 1908986