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Substance Name: Benzeneacetic acid, compd. with isoquinoline (1:1)
RN: 68140-47-6
InChIKey: QICJQBZNIXQTSK-UHFFFAOYSA-N

Molecular Formula

  • C9-H7-N.C8-H8-O2

Molecular Weight

  • 265.31
 
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Names and Synonyms

Synonym

  • Isoquinoline, phenyl acetic acid salt

Systematic Name

  • Benzeneacetic acid, compd. with isoquinoline (1:1)

Registry Numbers

CAS Registry Number

  • 68140-47-6

System Generated Number

  • 0068140476

Molecular Formulas

Molecular Formula

  • C9-H7-N.C8-H8-O2

Molecular Formula Fragments

  • C8-H8-O2
  • C9-H7-N
  • COMPONENT

Structure Descriptors

InChI

1S/C9H7N.C8H8O2/c1-2-4-9-7-10-6-5-8(9)3-1;9-8(10)6-7-4-2-1-3-5-7/h1-7H;1-5H,6H2,(H,9,10)

InChIKey

QICJQBZNIXQTSK-UHFFFAOYSA-N

Smiles

c12ccccc2ccnc1.c1(ccccc1)CC(O)=O