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(3R,4S)-2-keto-4-[(E)-4-ketobut-2-enyl]piperidine-1,3-dicarboxylic acid O3-benzyl ester O1-methyl ester
SpectraBase Compound ID xeTZHrx74x
InChI InChI=1S/C19H21NO6/c1-25-19(24)20-11-10-15(9-5-6-12-21)16(17(20)22)18(23)26-13-14-7-3-2-4-8-14/h2-8,12,15-16H,9-11,13H2,1H3/b6-5+/t15-,16+/m0/s1
InChIKey ZVBHWZZSKSKTMV-DZEZYYDTSA-N
Mol Weight 359.38 g/mol
Molecular Formula C19H21NO6
Exact Mass 359.136887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LoPn4uj3JqV
Name (3R,4S)-2-keto-4-[(E)-4-ketobut-2-enyl]piperidine-1,3-dicarboxylic acid O3-benzyl ester O1-methyl ester
Alternate Name(s) (3R,4S)-2-oxo-4-[(E)-4-oxobut-2-enyl]piperidine-1,3-dicarboxylic acid O1-methyl ester O3-(phenylmethyl) ester 3-O-benzyl 1-O-methyl (3R,4S)-2-oxo-4-[(E)-4-oxobut-2-enyl]piperidine-1,3-dicarboxylate O1-methyl O3-(phenylmethyl) (3R,4S)-2-oxidanylidene-4-[(E)-4-oxidanylidenebut-2-enyl]piperidine-1,3-dicarboxylate O3-benzyl O1-methyl (3R,4S)-2-oxo-4-[(E)-4-oxobut-2-enyl]piperidine-1,3-dicarboxylate
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Formula C19H21NO6
InChI InChI=1S/C19H21NO6/c1-25-19(24)20-11-10-15(9-5-6-12-21)16(17(20)22)18(23)26-13-14-7-3-2-4-8-14/h2-8,12,15-16H,9-11,13H2,1H3/b6-5+/t15-,16+/m0/s1
InChIKey ZVBHWZZSKSKTMV-DZEZYYDTSA-N
Molecular Weight 359.378 g/mol
SMILES C1(N(CC[C@@]([C@]1(C(OCc1ccccc1)=O)[H])(C\C=C\C=O)[H])C(=O)OC)=O
SPLASH splash10-052f-9520000000-89e77063dfed6838c0ec
Source of Spectrum F-56-4038-34
Wiley ID 857266