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Glycinamide, L-valyl-N-[1-(1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl)ethyl]-
SpectraBase Compound ID H1fqjZnnGB2
InChI InChI=1S/C21H34N4O4/c1-12(2)19(22)21(27)23-11-18(26)24-13(3)20-15-10-17(29-6)16(28-5)9-14(15)7-8-25(20)4/h9-10,12-13,19-20H,7-8,11,22H2,1-6H3,(H,23,27)(H,24,26)
InChIKey WZFBAZHBMOAWPY-UHFFFAOYSA-N
Mol Weight 406.5 g/mol
Molecular Formula C21H34N4O4
Exact Mass 406.258006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IdhOtgKKYgV
Name Glycinamide, L-valyl-N-[1-(1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl)ethyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 406.258005587 u
Formula C21H34N4O4
InChI InChI=1S/C21H34N4O4/c1-12(2)19(22)21(27)23-11-18(26)24-13(3)20-15-10-17(29-6)16(28-5)9-14(15)7-8-25(20)4/h9-10,12-13,19-20H,7-8,11,22H2,1-6H3,(H,23,27)(H,24,26)
InChIKey WZFBAZHBMOAWPY-UHFFFAOYSA-N
Molecular Weight 406.527 g/mol
SMILES C(NC(CNC([C@](C(C)C)(N)[H])=O)=O)(C)C1C2=C(C=C(C(=C2)OC)OC)CCN1C