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(3S,11aS)-1-Methoxy-3-(1-methylethyl)-3,6,11,11a-tetrahydro-4H-pyrazino[1,2-b]isoquinolin-4-one

View entire compound with spectra: 1 MS (GC)

(3S,11aS)-1-Methoxy-3-(1-methylethyl)-3,6,11,11a-tetrahydro-4H-pyrazino[1,2-b]isoquinolin-4-one
SpectraBase Compound ID 34h39S0BKS2
InChI InChI=1S/C16H20N2O2/c1-10(2)14-16(19)18-9-12-7-5-4-6-11(12)8-13(18)15(17-14)20-3/h4-7,10,13-14H,8-9H2,1-3H3/t13-,14-/m0/s1
InChIKey HFNPKZGBEPNXSB-KBPBESRZSA-N
Mol Weight 272.35 g/mol
Molecular Formula C16H20N2O2
Exact Mass 272.152478 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jcn1WvdsbXK
Name (3S,11aS)-1-Methoxy-3-(1-methylethyl)-3,6,11,11a-tetrahydro-4H-pyrazino[1,2-b]isoquinolin-4-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20N2O2
InChI InChI=1S/C16H20N2O2/c1-10(2)14-16(19)18-9-12-7-5-4-6-11(12)8-13(18)15(17-14)20-3/h4-7,10,13-14H,8-9H2,1-3H3/t13-,14-/m0/s1
InChIKey HFNPKZGBEPNXSB-KBPBESRZSA-N
Molecular Weight 272.348 g/mol
SMILES C1N2[C@@](Cc3ccccc13)(C(=N[C@](C2=O)(C(C)C)[H])OC)[H]
SPLASH splash10-00fr-0390000000-a780e9fd9d9715cdac14
Source of Spectrum U1-2002-3941-11
Synonyms (3S,11aS)-3-isopropyl-1-methoxy-3,6,11,11a-tetrahydro-4H-pyrazino[1,2-b]isoquinolin-4-one (3S,11aS)-3-isopropyl-1-methoxy-3,6,11,11a-tetrahydropyrazino[1,2-b]isoquinolin-4-one (3S,11aS)-1-methoxy-3-propan-2-yl-3,6,11,11a-tetrahydropyrazino[1,2-b]isoquinolin-4-one
Wiley ID 1523515