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CAS Number: 84348-38-9
(S)-1-(tert-butoxycarbonyl)-4-methylenepyrrolidine-2-carboxylic acid

Structure

(S)-1-(tert-butoxycarbonyl)-4-methylenepyrrolidine-2-carboxylic acid
Name: (S)-1-(tert-butoxycarbonyl)-4-methylenepyrrolidine-2-carboxylic acid
Synonyms:
General Information
Product Number: 84348389
CAS Registry Number: 84348-38-9
Name:
 
        1,​2-​Pyrrolidinedicarboxy​lic acid, 4-​methylene-​, 1-​(1,​1-​dimethylethyl) ester, (2S)​-
        1,​2-​Pyrrolidinedicarboxy​lic acid, 4-​methylene-​, 1-​(1,​1-​dimethylethyl) ester, (S)​-; (S)​-​1-​(tert-​Butoxycarbonyl)​-​4-​methylenepyrrolidine​-​2-​carboxylic acid; N-​tert-​Butoxycarbonyl-​4-​methylene-​L-​proline 
 
Chemical Formula: C11H17NO4
Exact Mass: 227.12
Molecular Weight: 227.26
m/z: 227.12 (100.0%), 228.12 (12.2%), 229.12 (1.5%)
Elemental Analysis: C, 58.14; H, 7.54; N, 6.16; O, 28.16
 
InChI: InChI=1S/C11H17NO4/c1-7-5-8(9(13)14)12(6-7)10(15)16-11(2,3)4/h8H,1,5-6H2,2-4H3,(H,13,14)/t8-/m0/s1
InChIKey: ULLGRIBXGPATMA-QMMMGPOBSA-N
Canonical SMILES : CC(C)(C)OC(=O)N1CC(=C)CC1C(=O)O
Isomeric SMILES: CC(C)(C)OC(=O)N1CC(=C)C[C@H]1C(=O)O

Specification

98%

References

PCT Int. Appl. (2014), WO 2014011518 A1 20140116. 

PCT Int. Appl. (2014), WO 2014002057 A1 20140103.

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