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Dimethyl N-Methyl-N-(methoxycarbonyl)-4,5-dehydro-L-homoglutamate
SpectraBase Compound ID B7SjJtYKYZ5
InChI InChI=1S/C11H17NO6/c1-12(11(15)18-4)8(10(14)17-3)6-5-7-9(13)16-2/h5,7-8H,6H2,1-4H3/b7-5+/t8-/m0/s1
InChIKey QHTCIWMGYJNFQI-IVGLGHLBSA-N
Mol Weight 259.26 g/mol
Molecular Formula C11H17NO6
Exact Mass 259.105587 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6QSfZpk8NJo
Name Dimethyl N-Methyl-N-(methoxycarbonyl)-4,5-dehydro-L-homoglutamate
Appearance Yellowish oil
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Formula C11H17NO6
InChI InChI=1S/C11H17NO6/c1-12(11(15)18-4)8(10(14)17-3)6-5-7-9(13)16-2/h5,7-8H,6H2,1-4H3/b7-5+/t8-/m0/s1
InChIKey QHTCIWMGYJNFQI-IVGLGHLBSA-N
Ionization Type EI
Optical Rotation [a]D = -23.73 (c = 0.45, CHCl3)
Reported Formula C11H17NO6
SMILES [C@@](N(C(=O)OC)C)(C\C=C\C(OC)=O)(C(OC)=O)[H]
SPLASH splash10-03di-0930000000-dab678580703c94681a5
Source of Spectrum WO2014125145A1
Wiley ID 1850075