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1H-2-Pyrindine-4-carboxylic acid, 2,4a,5,6,7,7a-hexahydro-7-methyl-1-oxo-6-[(3-pyridinylcarbonyl)oxy]-, methyl ester, [4aS-(4a.alpha.,6.alpha.,7.alpha.,7a.alpha.)]-
SpectraBase Compound ID 67X5Q0bWCrj
InChI InChI=1S/C17H18N2O5/c1-9-13(24-16(21)10-4-3-5-18-7-10)6-11-12(17(22)23-2)8-19-15(20)14(9)11/h3-5,7-9,11,13-14H,6H2,1-2H3,(H,19,20)
InChIKey IRRSEZXMTJDATB-UHFFFAOYSA-N
Mol Weight 330.34 g/mol
Molecular Formula C17H18N2O5
Exact Mass 330.121572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5rcoJS2HtzT
Name 1H-2-Pyrindine-4-carboxylic acid, 2,4a,5,6,7,7a-hexahydro-7-methyl-1-oxo-6-[(3-pyridinylcarbonyl)oxy]-, methyl ester, [4aS-(4a.alpha.,6.alpha.,7.alpha.,7a.alpha.)]-
Alternate Name(s) Methyl 7-methyl-1-oxo-6-[(3-pyridinylcarbonyl)oxy]-2,4a,5,6,7,7a-hexahydro-1H-cyclopenta[c]pyridine-4-carboxylate O-nicotinoyl-6-strychnovoline O6-nicotinoylstrychnovoline
CAS Registry Number 99339-52-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18N2O5
InChI InChI=1S/C17H18N2O5/c1-9-13(24-16(21)10-4-3-5-18-7-10)6-11-12(17(22)23-2)8-19-15(20)14(9)11/h3-5,7-9,11,13-14H,6H2,1-2H3,(H,19,20)
InChIKey IRRSEZXMTJDATB-UHFFFAOYSA-N
Molecular Weight 330.340 g/mol
SMILES N1C(C2C(C(=C1)C(=O)OC)CC(C2C)OC(c1cnccc1)=O)=O
SPLASH splash10-0a4i-1940000000-43a6c33ea3bacebce2fd
Source of Spectrum H-68-1684-4
Wiley ID 1327703