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3,6-Dihydrobenzo[1,2-b:4,3-b]dipyrrole-2,6-dicarboxylic acid, 6-(1,1-dimethylethyl) 2-ethyl ester
SpectraBase Compound ID JrE8Lpyiii1
InChI InChI=1S/C18H20N2O4/c1-5-23-16(21)14-10-12-11-8-9-20(17(22)24-18(2,3)4)15(11)7-6-13(12)19-14/h6-10,19H,5H2,1-4H3
InChIKey LPBABZNRDXHDJK-UHFFFAOYSA-N
Mol Weight 328.37 g/mol
Molecular Formula C18H20N2O4
Exact Mass 328.142307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID aEIjXCpwXB
Name 3,6-Dihydrobenzo[1,2-b:4,3-b]dipyrrole-2,6-dicarboxylic acid, 6-(1,1-dimethylethyl) 2-ethyl ester
Alternate Name(s) 6-tert-Butyl 2-ethyl pyrrolo[3,2-e]indole-2,6(3H)-dicarboxylate
CAS Registry Number 105518-43-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20N2O4
InChI InChI=1S/C18H20N2O4/c1-5-23-16(21)14-10-12-11-8-9-20(17(22)24-18(2,3)4)15(11)7-6-13(12)19-14/h6-10,19H,5H2,1-4H3
InChIKey LPBABZNRDXHDJK-UHFFFAOYSA-N
Molecular Weight 328.368 g/mol
SMILES [nH]1c(cc2c3cc[n](c3ccc12)C(OC(C)(C)C)=O)C(=O)OCC
SPLASH splash10-0006-9510000000-bb70d240db9e101a7bf8
Source of Spectrum J-52-24-18
Wiley ID 1326265