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CAS Number: 34993-56-1
1-ethynylpyrene

Structure

1-ethynylpyrene
Name: 1-ethynylpyrene
Synonyms:
General Information
Product Number: 34993561

CAS Registry Number 34993-56-1
Name:
Pyrene, 1-​ethynyl-
(1-Pyrenyl)acetylene
1-(1-Pyrenyl)ethyne
1-Ethynylpyrene

 

Chemical Formula: C18H10
Exact Mass: 226.08
Molecular Weight: 226.27
m/z: 226.08 (100.0%), 227.08 (19.6%), 228.08 (1.8%)

 

InChI:InChI=1S/C18H10/c1-2-12-6-7-15-9-8-13-4-3-5-14-10-11-16(12)18(15)17(13)14/h1,3-11H

InChI Key:VEBUBSLYGRMOSZ-UHFFFAOYSA-N

Canonical SMILES:C#CC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

Specification

98%

References
  1. (4) Goze, Christine; Inorganic Chemistry 2007, V46(18), P7341-7350 CAPLUS
  2. (5) Coleman, Anthony; Inorganic Chemistry 2008, V47(23), P10980-10990 CAPLUS
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