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CAS Number: 1421922-95-3
5-acetylisoindolin-1-one

Structure

5-acetylisoindolin-1-one
Name: 5-acetylisoindolin-1-one
Synonyms:
General Information
Product Number: 1421922953
CAS Registry Number: 1421922-95-3
Name:
        1H-​Isoindol-​1-​one, 5-​acetyl-​2,​3-​dihydro-
 
Chemical Formula: C10H9NO2
Exact Mass: 175.06
Molecular Weight: 175.18
m/z: 175.06 (100.0%), 176.07 (11.0%)
Elemental Analysis: C, 68.56; H, 5.18; N, 8.00; O, 18.27
 
InChI: InChI=1S/C10H9NO2/c1-6(12)7-2-3-9-8(4-7)5-11-10(9)13/h2-4H,5H2,1H3,(H,11,13)
InChIKey: HZYYOSSJNNELLX-UHFFFAOYSA-N
Canonical SMILES : CC(=O)C1=CC2=C(C=C1)C(=O)NC2

Specification

98%

References

PCT Int. Appl. (2013), WO 2013018735 A1 20130207.

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