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1H-Pyrrole-3-carboxylic acid, 2,5-Dihydro-4-phenyl-, Ethyl Ester, Monohydrochloride

View entire compound with spectra: 1 MS (GC)

1H-Pyrrole-3-carboxylic acid, 2,5-Dihydro-4-phenyl-, Ethyl Ester, Monohydrochloride
SpectraBase Compound ID JjmmULJ4z3G
InChI InChI=1S/C13H15NO2.ClH/c1-2-16-13(15)12-9-14-8-11(12)10-6-4-3-5-7-10;/h3-7,14H,2,8-9H2,1H3;1H
InChIKey MBFGLWAMQBZRKA-UHFFFAOYSA-N
Mol Weight 253.73 g/mol
Molecular Formula C13H16ClNO2
Exact Mass 253.086956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FpMzXpm2s8w
Name 1H-Pyrrole-3-carboxylic acid, 2,5-Dihydro-4-phenyl-, Ethyl Ester, Monohydrochloride
Alternate Name(s) Ethyl 4-phenyl-2,5-dihydro-1H-pyrrole-3-carboxylate hydrochloride
CAS Registry Number 137569-76-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16ClNO2
InChI InChI=1S/C13H15NO2.ClH/c1-2-16-13(15)12-9-14-8-11(12)10-6-4-3-5-7-10;/h3-7,14H,2,8-9H2,1H3;1H
InChIKey MBFGLWAMQBZRKA-UHFFFAOYSA-N
Molecular Weight 253.729 g/mol
SMILES Cl.N1CC(=C(C1)C(=O)OCC)c1ccccc1
SPLASH splash10-0006-0910000000-ea4a7cd8c4a1bf76b2ec
Source of Spectrum F2-35-239-21
Wiley ID 1574253