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(2S*,5S*)-2,5-Dimethyl-7-oxo-2,3,4,5,6,7-hexahydro[1]pyridine-1-carboxylic Acid Benzyl Ester
SpectraBase Compound ID FroPAaxAMNv
InChI InChI=1S/C18H21NO3/c1-12-10-16(20)17-15(12)9-8-13(2)19(17)18(21)22-11-14-6-4-3-5-7-14/h3-7,12-13H,8-11H2,1-2H3/t12-,13-/m0/s1
InChIKey AHQYAMAVKAJFLV-STQMWFEESA-N
Mol Weight 299.37 g/mol
Molecular Formula C18H21NO3
Exact Mass 299.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AdNkG6dz3tQ
Name (2S*,5S*)-2,5-Dimethyl-7-oxo-2,3,4,5,6,7-hexahydro[1]pyridine-1-carboxylic Acid Benzyl Ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NO3
InChI InChI=1S/C18H21NO3/c1-12-10-16(20)17-15(12)9-8-13(2)19(17)18(21)22-11-14-6-4-3-5-7-14/h3-7,12-13H,8-11H2,1-2H3/t12-,13-/m0/s1
InChIKey AHQYAMAVKAJFLV-STQMWFEESA-N
Molecular Weight 299.370 g/mol
SMILES C=12N(C(OCc3ccccc3)=O)[C@@](C)(CCC1[C@@](C)(CC2=O)[H])[H]
SPLASH splash10-0006-9070000000-ab3054def0879703edcb
Source of Spectrum F-68-9738-46
Synonyms (2S,5S)-2,5-dimethyl-7-oxo-3,4,5,6-tetrahydro-2H-cyclopenta[b]pyridine-1-carboxylic acid (phenylmethyl) ester benzyl (2S,5S)-2,5-dimethyl-7-oxo-3,4,5,6-tetrahydro-2H-cyclopenta[b]pyridine-1-carboxylate (phenylmethyl) (2S,5S)-2,5-dimethyl-7-oxidanylidene-3,4,5,6-tetrahydro-2H-cyclopenta[b]pyridine-1-carboxylate
Wiley ID 1573896