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Methyl (1R,2S)-2-[2-(dimethylamino)-2-oxoethyl]-2,3-dimethyl-cyclohex-3-en-1-carboxylate
SpectraBase Compound ID GkTtOaHHihf
InChI InChI=1S/C14H23NO3/c1-10-7-6-8-11(13(17)18-5)14(10,2)9-12(16)15(3)4/h7,11H,6,8-9H2,1-5H3/t11-,14+/m0/s1
InChIKey CAPQHBBCVQMHKN-SMDDNHRTSA-N
Mol Weight 253.34 g/mol
Molecular Formula C14H23NO3
Exact Mass 253.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FV1xSf4pYno
Name Methyl (1R,2S)-2-[2-(dimethylamino)-2-oxoethyl]-2,3-dimethyl-cyclohex-3-en-1-carboxylate
Appearance Light yellow oil
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Formula C14H23NO3
InChI InChI=1S/C14H23NO3/c1-10-7-6-8-11(13(17)18-5)14(10,2)9-12(16)15(3)4/h7,11H,6,8-9H2,1-5H3/t11-,14+/m0/s1
InChIKey CAPQHBBCVQMHKN-SMDDNHRTSA-N
Instrument Name Finnigan MAT 8200 or Finnigan MAT 95 or Finnigan MAT 95 XL
Ionization Type EI
Literature Reference DOI 10.24820/ark.5550190.p011.422
Molecular Weight 253.342 g/mol
SMILES C1(=CCC[C@]([C@@]1(CC(N(C)C)=O)C)(C(OC)=O)[H])C
SPLASH splash10-000i-9210000000-c623ead6661a4a08fcc4
Source of Spectrum ARK-2021-51-trans-2
Thin-Layer Chromatography Rf = 0.37 (Ether)
Wiley ID 1873120