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2-Pyridinecarboxylic acid, 6-ethoxy-1,4,5,6-tetrahydro-4-methyl-1-(methylsulfonyl)-, ethyl ester, cis-
SpectraBase Compound ID KCAXxjW3mj2
InChI InChI=1S/C12H21NO5S/c1-5-17-11-8-9(3)7-10(12(14)18-6-2)13(11)19(4,15)16/h7,9,11H,5-6,8H2,1-4H3/t9-,11-/m0/s1
InChIKey ZFZVMWYPSNDPNN-ONGXEEELSA-N
Mol Weight 291.36 g/mol
Molecular Formula C12H21NO5S
Exact Mass 291.114044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7NUHIQ7kMm9
Name 2-Pyridinecarboxylic acid, 6-ethoxy-1,4,5,6-tetrahydro-4-methyl-1-(methylsulfonyl)-, ethyl ester, cis-
CAS Registry Number 132646-91-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H21NO5S
InChI InChI=1S/C12H21NO5S/c1-5-17-11-8-9(3)7-10(12(14)18-6-2)13(11)19(4,15)16/h7,9,11H,5-6,8H2,1-4H3/t9-,11-/m0/s1
InChIKey ZFZVMWYPSNDPNN-ONGXEEELSA-N
Molecular Weight 291.362 g/mol
SMILES C=1(N([C@](C[C@](C1)(C)[H])(OCC)[H])S(=O)(=O)C)C(=O)OCC
SPLASH splash10-014i-0920000000-da4901c50251def107ca
Source of Spectrum C-113-1724-22
Synonyms (2R*,4S*)-1-(methylsufonyl)-2-ethoxy-4-methyl-6-(ethoxycarbonyl)-1,2,3,4-hydropyridine Ethyl (4R,6S)-6-ethoxy-4-methyl-1-(methylsulfonyl)-1,4,5,6-tetrahydro-2-pyridinecarboxylate
Wiley ID 1294351