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(2S*)-1,2-[(S*)-1-(3,4-Dimethyl-3-pentenyl)-1-(methoxycarbonyl)methylene]-5-ethoxycarbonylindoline
SpectraBase Compound ID LEGoTDl5857
InChI InChI=1S/C21H27NO4/c1-6-26-19(23)15-7-8-17-16(11-15)12-18-21(22(17)18,20(24)25-5)10-9-14(4)13(2)3/h7-8,11,18H,6,9-10,12H2,1-5H3
InChIKey BJUXBDDUTWCFLP-UHFFFAOYSA-N
Mol Weight 357.45 g/mol
Molecular Formula C21H27NO4
Exact Mass 357.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID UEYXeeduq
Name (2S*)-1,2-[(S*)-1-(3,4-Dimethyl-3-pentenyl)-1-(methoxycarbonyl)methylene]-5-ethoxycarbonylindoline
Alternate Name(s) (2S*)-1,2-[(R*)-1-(3,4-Dimethyl-3-pentenyl)-1-(methoxycarbonyl)methylene]-5-ethoxycarbonylindoline 5-Ethyl 1-methyl 1-(3,4-dimethyl-3-pentenyl)-7,7a-dihydro-1H-azirino[1,2-a]indole-1,5-dicarboxylate
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Formula C21H27NO4
InChI InChI=1S/C21H27NO4/c1-6-26-19(23)15-7-8-17-16(11-15)12-18-21(22(17)18,20(24)25-5)10-9-14(4)13(2)3/h7-8,11,18H,6,9-10,12H2,1-5H3
InChIKey BJUXBDDUTWCFLP-UHFFFAOYSA-N
Molecular Weight 357.450 g/mol
SMILES C1(N2c3ccc(C(=O)OCC)cc3CC12)(C(=O)OC)CCC(=C(C)C)C
SPLASH splash10-006x-6790000000-09429db6500c69b63efd
Source of Spectrum F-52-10624-36
Wiley ID 798186