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(S)-HEXAHYDRO-2-PHENYL-1H-PYRROLO[1,2-c]IMIDAZOLE-3-CARBOXYLIC ACID, METHYL ESTER
SpectraBase Compound ID H3iJCIovCAB
InChI InChI=1S/C14H18N2O2/c1-18-14(17)13-15-9-5-8-12(15)10-16(13)11-6-3-2-4-7-11/h2-4,6-7,12-13H,5,8-10H2,1H3/t12-,13+/m0/s1
InChIKey IVRYBIASBRGJQI-QWHCGFSZSA-N
Mol Weight 246.31 g/mol
Molecular Formula C14H18N2O2
Exact Mass 246.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 92uoYHYTuGQ
Name 2-Phenyl-1,3,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazole-3-carboxylic acid methyl ester
Alternate Name(s) 2-Phenyl-1,3,5,6,7,7a-hexahydropyrrol[1,2-c]imidazole-3-carboxylic acid methyl ester Methyl 2-phenyl-1,3,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazole-3-carboxylate Methyl 2-phenylhexahydro-1H-pyrrolo[1,2-c]imidazole-3-carboxylate (3R,7aS)-2-phenyl-1,3,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazole-3-carboxylic acid methyl ester Methyl (3R,7aS)-2-phenyl-1,3,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazole-3-carboxylate
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Formula C14H18N2O2
InChI InChI=1S/C14H18N2O2/c1-18-14(17)13-15-9-5-8-12(15)10-16(13)11-6-3-2-4-7-11/h2-4,6-7,12-13H,5,8-10H2,1H3/t12-,13+/m0/s1
InChIKey IVRYBIASBRGJQI-QWHCGFSZSA-N
Molecular Weight 246.310 g/mol
SMILES [C@]1(N(C[C@@]2(CCCN12)[H])c1ccccc1)(C(=O)OC)[H]
SPLASH splash10-002e-9740000000-9a1a7434ed2e7d4a6776
Source of Spectrum KC-0-2122-10
Wiley ID 786394