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CAS Number: 1094091-46-9
3-bromo-7-(tert-butoxycarbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxylic acid

Structure

3-bromo-7-(tert-butoxycarbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxylic acid
Name: 3-bromo-7-(tert-butoxycarbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxylic acid
Synonyms:
General Information
Product Number: 1094091469

CAS Registry Number 1094091-46-9
Name:
Imidazo[1,​5-​a]​pyrazine-​1,​7(8H)​-​dicarboxylic acid, 3-​bromo-​5,​6-​dihydro-​, 7-​(1,​1-​dimethylethyl) ester
3-Bromo-7-(tert-butoxycarbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxylic acid

 

Chemical Formula: C12H16BrN3O4
Exact Mass: 345.03
Molecular Weight: 346.18
m/z: 345.03 (100.0%), 347.03 (97.4%), 348.03 (13.9%), 346.04 (13.3%), 347.04 (1.6%), 346.03 (1.1%)

 

InChI:InChI=1S/C12H16BrN3O4/c1-12(2,3)20-11(19)15-4-5-16-7(6-15)8(9(17)18)14-10(16)13/h4-6H2,1-3H3,(H,17,18)

InChI Key:XPSHWWXTUGQNPA-UHFFFAOYSA-N

Canonical SMILES:CC(C)(C)OC(=O)N1CCN2C(=C(N=C2Br)C(=O)O)C1

Specification

98%

References

PCT Int. Appl. (2008), WO 2008157751 A2 20081224. 

U.S. Pat. Appl. Publ. (2011), US 20110034443 A1 20110210.                                 

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