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(4aS,6S,7R,7aS)-7-methyl-6-nicotinoyloxy-2,4a,5,6,7,7a-hexahydro-1H-2-pyrindine-4-carboxylic acid methyl ester
SpectraBase Compound ID FrGp5L6xIPn
InChI InChI=1S/C17H20N2O4/c1-10-13-8-19-9-14(17(21)22-2)12(13)6-15(10)23-16(20)11-4-3-5-18-7-11/h3-5,7,9-10,12-13,15,19H,6,8H2,1-2H3/t10-,12+,13-,15+/m1/s1
InChIKey POMSZMYEBAWFCN-ZRQNBYAXSA-N
Mol Weight 316.36 g/mol
Molecular Formula C17H20N2O4
Exact Mass 316.142307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2FpB2YsGOzB
Name (4aS,6S,7R,7aS)-7-methyl-6-nicotinoyloxy-2,4a,5,6,7,7a-hexahydro-1H-2-pyrindine-4-carboxylic acid methyl ester
CAS Registry Number 99339-53-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20N2O4
InChI InChI=1S/C17H20N2O4/c1-10-13-8-19-9-14(17(21)22-2)12(13)6-15(10)23-16(20)11-4-3-5-18-7-11/h3-5,7,9-10,12-13,15,19H,6,8H2,1-2H3/t10-,12+,13-,15+/m1/s1
InChIKey POMSZMYEBAWFCN-ZRQNBYAXSA-N
Molecular Weight 316.357 g/mol
SMILES N1C[C@]2([C@@](C(=C1)C(=O)OC)(C[C@@]([C@@]2(C)[H])(OC(c1cnccc1)=O)[H])[H])[H]
SPLASH splash10-0006-0900000000-94e89d407a6ba20841bf
Source of Spectrum H-68-1684-5
Synonyms (4aS,6S,7R,7aS)-7-methyl-6-[oxo(3-pyridinyl)methoxy]-2,4a,5,6,7,7a-hexahydro-1H-cyclopenta[c]pyridine-4-carboxylic acid methyl ester Methyl (4aS,6S,7R,7aS)-7-methyl-6-(pyridine-3-carbonyloxy)-2,4a,5,6,7,7a-hexahydro-1H-cyclopenta[c]pyridine-4-carboxylate Methyl (4aS,6S,7R,7aS)-7-methyl-6-pyridin-3-ylcarbonyloxy-2,4a,5,6,7,7a-hexahydro-1H-cyclopenta[c]pyridine-4-carboxylate
Wiley ID 1316700