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1-Benzyl-5-ethoxycarbonyl-7-methoxycarbonyl-7-methylhexahydro-1H-pyrrolo[1,2-a]imidazole
SpectraBase Compound ID 2VrLRxPT6Uh
InChI InChI=1S/C19H26N2O4/c1-4-25-16(22)15-12-19(2,18(23)24-3)17-20(10-11-21(15)17)13-14-8-6-5-7-9-14/h5-9,15,17H,4,10-13H2,1-3H3/t15-,17+,19-/m1/s1
InChIKey DDYIYBAXJIKMFB-HHXXYDBFSA-N
Mol Weight 346.43 g/mol
Molecular Formula C19H26N2O4
Exact Mass 346.189257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FrCArbjArEd
Name 1-Benzyl-5-ethoxycarbonyl-7-methoxycarbonyl-7-methylhexahydro-1H-pyrrolo[1,2-a]imidazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26N2O4
InChI InChI=1S/C19H26N2O4/c1-4-25-16(22)15-12-19(2,18(23)24-3)17-20(10-11-21(15)17)13-14-8-6-5-7-9-14/h5-9,15,17H,4,10-13H2,1-3H3/t15-,17+,19-/m1/s1
InChIKey DDYIYBAXJIKMFB-HHXXYDBFSA-N
Molecular Weight 346.427 g/mol
SMILES [C@]1([C@@]2(N(CCN2Cc2ccccc2)[C@](C1)(C(=O)OCC)[H])[H])(C(=O)OC)C
SPLASH splash10-052e-5890000000-56dde0b0c66d3b0c0577
Source of Spectrum KC-1-2066-7
Synonyms (5R,7R,7aS)-1-Benzyl-7-methyl-hexahydro-pyrrolo[1,2-a]imidazole-5,7-dicarboxylic acid 5-ethyl ester 7-methyl ester 5-Ethyl 7-methyl 1-benzyl-7-methylhexahydro-1H-pyrrolo[1,2-a]imidazole-5,7-dicarboxylate
Wiley ID 825822