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(6S)-6-[(1S,2S)-1,2-bis(phenylmethoxy)pent-3-ynyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid ethyl ester
SpectraBase Compound ID Ljadz1TeCOs
InChI InChI=1S/C27H31NO4/c1-3-13-25(31-20-22-14-7-5-8-15-22)26(32-21-23-16-9-6-10-17-23)24-18-11-12-19-28(24)27(29)30-4-2/h5-11,14-18,24-26H,4,12,19-21H2,1-2H3/t24-,25-,26-/m0/s1
InChIKey UBXYDYWRMZJAKS-GSDHBNRESA-N
Mol Weight 433.55 g/mol
Molecular Formula C27H31NO4
Exact Mass 433.225308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JzGwyDNc16D
Name (6S)-6-[(1S,2S)-1,2-bis(phenylmethoxy)pent-3-ynyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid ethyl ester
Alternate Name(s) (6S)-6-[(1S,2S)-1,2-dibenzoxypent-3-ynyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid ethyl ester Ethyl (6S)-6-[(1S,2S)-1,2-bis(phenylmethoxy)pent-3-ynyl]-3,6-dihydro-2H-pyridine-1-carboxylate Ethyl (6S)-6-[(1S,2S)-1,2-dibenzyloxypent-3-ynyl]-3,6-dihydro-2H-pyridine-1-carboxylate
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Formula C27H31NO4
InChI InChI=1S/C27H31NO4/c1-3-13-25(31-20-22-14-7-5-8-15-22)26(32-21-23-16-9-6-10-17-23)24-18-11-12-19-28(24)27(29)30-4-2/h5-11,14-18,24-26H,4,12,19-21H2,1-2H3/t24-,25-,26-/m0/s1
InChIKey UBXYDYWRMZJAKS-GSDHBNRESA-N
Molecular Weight 433.548 g/mol
SMILES [C@]1(N(CCC=C1)C(=O)OCC)([C@](OCc1ccccc1)([C@](C#CC)(OCc1ccccc1)[H])[H])[H]
SPLASH splash10-0ai0-0890000000-ff04724d9efa3d6d467b
Source of Spectrum C-118-1058-13
Wiley ID 759459