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(3R,11aS)-1-methoxy-3-(3-methylbut-2-enyl)-3,6,11,11a-tetrahydropyrazino[1,2-b]isoquinolin-4-one
SpectraBase Compound ID BAN41Z0trko
InChI InChI=1S/C18H22N2O2/c1-12(2)8-9-15-18(21)20-11-14-7-5-4-6-13(14)10-16(20)17(19-15)22-3/h4-8,15-16H,9-11H2,1-3H3/t15-,16+/m1/s1
InChIKey XBIOXZZJKWQDLO-CVEARBPZSA-N
Mol Weight 298.39 g/mol
Molecular Formula C18H22N2O2
Exact Mass 298.168128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1u95dwhhXfy
Name (3R,11aS)-1-methoxy-3-(3-methylbut-2-enyl)-3,6,11,11a-tetrahydropyrazino[1,2-b]isoquinolin-4-one
Alternate Name(s) (3R,11aS)-1-methoxy-3-(3-methylbut-2-enyl)-3,6,11,11a-tetrahydropyrazin[1,2-b]isoquinolin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22N2O2
InChI InChI=1S/C18H22N2O2/c1-12(2)8-9-15-18(21)20-11-14-7-5-4-6-13(14)10-16(20)17(19-15)22-3/h4-8,15-16H,9-11H2,1-3H3/t15-,16+/m1/s1
InChIKey XBIOXZZJKWQDLO-CVEARBPZSA-N
Molecular Weight 298.386 g/mol
SMILES C1N2[C@@](Cc3ccccc13)(C(=N[C@@](C2=O)(CC=C(C)C)[H])OC)[H]
SPLASH splash10-0f89-0590000000-5c770b19c176af3247d4
Source of Spectrum U1-2002-3941-10
Wiley ID 1523512