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Structure

2-Hydroxy-2-oxoacetate; 7-pyrrolidin-1-ium-1-ylhept-5-yn-2-one

CAS
3921-90-2
Catalog Number
ACM3921902
Category
Other Products
Molecular Weight
269.294 g/mol
Molecular Formula
C13H19NO5

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Specification

Synonyms
7-Pyrrolidin-1-ylhept-5-yn-2-one hydrogen oxalate; 7-pyrrolidin-1-ium-1-ylhept-5-yn-2-one;
IUPAC Name
2-hydroxy-2-oxoacetate;7-pyrrolidin-1-ium-1-ylhept-5-yn-2-one
Canonical SMILES
CC(=O)CCC#CC[NH+]1CCCC1.C(=O)(C(=O)[O-])O
InChI Key
OBVQUXRHVYQWMZ-UHFFFAOYSA-N
Exact Mass
269.12600
H-Bond Acceptor
5
H-Bond Donor
2
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