(Q82857702)

English

methyl 2-acetamidoheptanoate tautomer

chemical compound

heptanoic acid 2-acetylaminomethyl ester

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Statements

type of chemical entity

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chemical compound

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201.136493468 dalton

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based on heuristic

inferred from SMILES

methyl 2-acetamidoheptanoate

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chemical formula

C₁₀H₁₉NO₃

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canonical SMILES

CCCCCC(NC(C)=O)C(=O)OC

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Identifiers

InChI=1S/C10H19NO3/c1-4-5-6-7-9(10(13)14-3)11-8(2)12/h9H,4-7H2,1-3H3,(H,11,12)

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FWWZBHSEVOSEHV-UHFFFAOYSA-N

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1 reference

26 December 2021

DSSTox substance ID

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DSSTOX compound identifier

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