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(5Z,6S,7S,7aS)-5-ethylidene-6,7-dihydroxy-3,6,7,7a-tetrahydro-2H-1-pyrindine-1-carboxylic acid ethyl ester
SpectraBase Compound ID 2ly99zBP7EQ
InChI InChI=1S/C13H19NO4/c1-3-8-9-6-5-7-14(13(17)18-4-2)10(9)12(16)11(8)15/h3,6,10-12,15-16H,4-5,7H2,1-2H3/b8-3-/t10-,11-,12-/m0/s1
InChIKey KEFRJTFAGKIKDM-PNXMJJCVSA-N
Mol Weight 253.3 g/mol
Molecular Formula C13H19NO4
Exact Mass 253.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FQylgF1eGag
Name (5Z,6S,7S,7aS)-5-ethylidene-6,7-dihydroxy-3,6,7,7a-tetrahydro-2H-1-pyrindine-1-carboxylic acid ethyl ester
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Formula C13H19NO4
InChI InChI=1S/C13H19NO4/c1-3-8-9-6-5-7-14(13(17)18-4-2)10(9)12(16)11(8)15/h3,6,10-12,15-16H,4-5,7H2,1-2H3/b8-3-/t10-,11-,12-/m0/s1
InChIKey KEFRJTFAGKIKDM-PNXMJJCVSA-N
Molecular Weight 253.298 g/mol
SMILES O[C@]1([C@@]2(C(\C([C@@]1(O)[H])=C/C)=CCCN2C(=O)OCC)[H])[H]
SPLASH splash10-0ue9-0490000000-9aa1a80b833d169fc7ac
Source of Spectrum C-118-1059-17
Synonyms (6S,7S,7aS)-5-Eth-(Z)-ylidene-6,7-dihydroxy-2,3,5,6,7,7a-hexahydro-[1]pyrindine-1-carboxylic acid ethyl ester 2-(Ethoxycarbonyl)-8,9-dihydroxy-7(Z)-ethylidene-2-azabicyclo[4.3.0]non-5-ene (5Z,6S,7S,7aS)-5-ethylidene-6,7-dihydroxy-3,6,7,7a-tetrahydro-2H-cyclopenta[b]pyridine-1-carboxylic acid ethyl ester Ethyl (5Z,6S,7S,7aS)-5-ethylidene-6,7-bis(oxidanyl)-3,6,7,7a-tetrahydro-2H-cyclopenta[b]pyridine-1-carboxylate Ethyl (5Z,6S,7S,7aS)-5-ethylidene-6,7-dihydroxy-3,6,7,7a-tetrahydro-2H-cyclopenta[b]pyridine-1-carboxylate
Wiley ID 1698331