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CAS Number: 467435-75-2
tert-butyl 2-ethynyl-1H-pyrrole-1-carboxylate

Structure

 tert-butyl 2-ethynyl-1H-pyrrole-1-carboxylate
Name: tert-butyl 2-ethynyl-1H-pyrrole-1-carboxylate
Synonyms:
General Information
Product Number: 467435752

CAS Registry Number 467435-75-2
Name:
1H-?Pyrrole-?1-?carboxylic acid, 2-?ethynyl-?, 1,?1-?dimethylethyl ester

 

Chemical Formula: C11H13NO2
Exact Mass: 191.09
Molecular Weight: 191.23
m/z: 191.09 (100.0%), 192.10 (12.1%), 193.10 (1.1%)

 

InChI:InChI=1S/C11H13NO2/c1-5-9-7-6-8-12(9)10(13)14-11(2,3)4/h1,6-8H,2-4H3

InChI Key:BXYGCGZVOKUUCH-UHFFFAOYSA-N

Canonical SMILES:CC(C)(C)OC(=O)N1C=CC=C1C#C

Specification

98%
References
  1. (1) Liao, Jen-Hai; Organic Letters 2002, V4(18), P3107-3110 CAPLUS
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