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1-(Phenyl-D5)-1-deuterio-2-(methoxycarbonyl)methyl-2-azaspiro[4.5]decan-9-one isomer
SpectraBase Compound ID 9HtMWCIzwpe
InChI InChI=1S/C18H23NO3/c1-22-16(21)13-19-11-10-18(9-5-8-15(20)12-18)17(19)14-6-3-2-4-7-14/h2-4,6-7,17H,5,8-13H2,1H3/i2D,3D,4D,6D,7D,17D
InChIKey JQJVISDYZHOCOF-RYZDXPNPSA-N
Mol Weight 307.42 g/mol
Molecular Formula C18H172D6NO3
Exact Mass 307.205454 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EMTHCMKBhso
Name 1-(Phenyl-D5)-1-deuterio-2-(methoxycarbonyl)methyl-2-azaspiro[4.5]decan-9-one isomer
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17D6NO3
InChI InChI=1S/C18H23NO3/c1-22-16(21)13-19-11-10-18(9-5-8-15(20)12-18)17(19)14-6-3-2-4-7-14/h2-4,6-7,17H,5,8-13H2,1H3/i2D,3D,4D,6D,7D,17D
InChIKey JQJVISDYZHOCOF-RYZDXPNPSA-N
Molecular Weight 307.423 g/mol
SMILES C1(N(CCC11CC(=O)CCC1)CC(=O)OC)(c1c(c([2D])c(c(c1[2D])[2D])[2D])[2D])[2D]
SPLASH splash10-0002-9460000000-0497fd9ad924b4a9547e
Source of Spectrum C-113-8878-76
Wiley ID 1303978