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3-[(2R)-2-[(E)-1-(1,3-benzodioxol-5-yl)-3-ethoxy-3-keto-prop-1-enyl]ethylenimin-1-yl]-3-keto-propionic acid methyl ester
SpectraBase Compound ID 8cxUoTcLUoU
InChI InChI=1S/C18H19NO7/c1-3-24-18(22)7-12(11-4-5-14-15(6-11)26-10-25-14)13-9-19(13)16(20)8-17(21)23-2/h4-7,13H,3,8-10H2,1-2H3/b12-7+/t13-,19?/m0/s1
InChIKey NPZHYYMNRXVMRR-CMEPEWBLSA-N
Mol Weight 361.35 g/mol
Molecular Formula C18H19NO7
Exact Mass 361.116152 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CdrF4it9ToT
Name 3-[(2R)-2-[(E)-1-(1,3-benzodioxol-5-yl)-3-ethoxy-3-keto-prop-1-enyl]ethylenimin-1-yl]-3-keto-propionic acid methyl ester
Alternate Name(s) 3-[(2R)-2-[(E)-1-(1,3-benzodioxol-5-yl)-3-ethoxy-3-oxoprop-1-enyl]-1-aziridinyl]-3-oxopropanoic acid methyl ester Methyl 3-[(2R)-2-[(E)-1-(1,3-benzodioxol-5-yl)-3-ethoxy-3-oxidanylidene-prop-1-enyl]aziridin-1-yl]-3-oxidanylidene-propanoate Methyl 3-[(2R)-2-[(E)-1-(1,3-benzodioxol-5-yl)-3-ethoxy-3-oxo-prop-1-enyl]aziridin-1-yl]-3-oxo-propanoate
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Formula C18H19NO7
InChI InChI=1S/C18H19NO7/c1-3-24-18(22)7-12(11-4-5-14-15(6-11)26-10-25-14)13-9-19(13)16(20)8-17(21)23-2/h4-7,13H,3,8-10H2,1-2H3/b12-7+/t13-,19?/m0/s1
InChIKey NPZHYYMNRXVMRR-CMEPEWBLSA-N
Molecular Weight 361.350 g/mol
SMILES [C@]1(N(C1)C(CC(=O)OC)=O)(\C(c1cc2OCOc2cc1)=C\C(=O)OCC)[H]
SPLASH splash10-0gwr-0492000000-5fc51e6a473ab945eb90
Source of Spectrum F-55-6898-12
Wiley ID 838185