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(3R,11aS)-1-methoxy-3-(2-methylpropyl)-3,6,11,11a-tetrahydropyrazino[1,2-b]isoquinolin-4-one

View entire compound with spectra: 1 MS (GC)

(3R,11aS)-1-methoxy-3-(2-methylpropyl)-3,6,11,11a-tetrahydropyrazino[1,2-b]isoquinolin-4-one
SpectraBase Compound ID 1YSVyDRfEf7
InChI InChI=1S/C17H22N2O2/c1-11(2)8-14-17(20)19-10-13-7-5-4-6-12(13)9-15(19)16(18-14)21-3/h4-7,11,14-15H,8-10H2,1-3H3/t14-,15+/m1/s1
InChIKey RHYBLKUPYCAYMH-CABCVRRESA-N
Mol Weight 286.38 g/mol
Molecular Formula C17H22N2O2
Exact Mass 286.168128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 15tPz5cUfcc
Name (3R,11aS)-1-methoxy-3-(2-methylpropyl)-3,6,11,11a-tetrahydropyrazino[1,2-b]isoquinolin-4-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22N2O2
InChI InChI=1S/C17H22N2O2/c1-11(2)8-14-17(20)19-10-13-7-5-4-6-12(13)9-15(19)16(18-14)21-3/h4-7,11,14-15H,8-10H2,1-3H3/t14-,15+/m1/s1
InChIKey RHYBLKUPYCAYMH-CABCVRRESA-N
Molecular Weight 286.375 g/mol
SMILES C1N2[C@@](Cc3ccccc13)(C(=N[C@@](C2=O)(CC(C)C)[H])OC)[H]
SPLASH splash10-001i-0980000000-39b4145cc2ffa03a8745
Source of Spectrum U1-2002-3940-10
Synonyms (3R,11aS)-3-isobutyl-1-methoxy-3,6,11,11a-tetrahydropyrazino[1,2-b]isoquinolin-4-one (3R,11aS)-3-isobutyl-1-methoxy-3,6,11,11a-tetrahydropyrazin[1,2-b]isoquinolin-4-one
Wiley ID 1523520