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KTYCEKRHSTYKEO-UHFFFAOYSA-N
SpectraBase Compound ID 3UcjxwWQq2j
InChI InChI=1S/C19H23N3O2/c1-19(2,3)24-18(23)17-11-16(12-20)14-22(17)10-9-21-13-15-7-5-4-6-8-15/h4-8,11,14,21H,9-10,13H2,1-3H3
InChIKey KTYCEKRHSTYKEO-UHFFFAOYSA-N
Mol Weight 325.41 g/mol
Molecular Formula C19H23N3O2
Exact Mass 325.179027 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 51h3gq1ebY5
Name 1-[2-(benzylamino)ethyl]-4-cyano-pyrrole-2-carboxylic acid tert-butyl ester
Alternate Name(s) 4-cyano-1-[2-[(phenylmethyl)amino]ethyl]-2-pyrrolecarboxylic acid tert-butyl ester tert-Butyl 1-[2-(benzylamino)ethyl]-4-cyano-pyrrole-2-carboxylate tert-Butyl 4-cyano-1-[2-[(phenylmethyl)amino]ethyl]pyrrole-2-carboxylate
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Formula C19H23N3O2
InChI InChI=1S/C19H23N3O2/c1-19(2,3)24-18(23)17-11-16(12-20)14-22(17)10-9-21-13-15-7-5-4-6-8-15/h4-8,11,14,21H,9-10,13H2,1-3H3
InChIKey KTYCEKRHSTYKEO-UHFFFAOYSA-N
Molecular Weight 325.412 g/mol
SMILES N(CC[n]1c(C(OC(C)(C)C)=O)cc(C#N)c1)Cc1ccccc1
SPLASH splash10-006x-9500000000-d0408f0573962db35e38
Source of Spectrum KC-1-2069-21
Wiley ID 825805