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Substance Name: Benzoic acid, 2-hydroxy-, 1,3-dimethyl-3-buten-1-yl ester
RN: 80118-10-1
InChIKey: VBOJHXQVOIZGQO-UHFFFAOYSA-N

Classification Code

  • TSCA Flag PMN (a Commenced PMN (Premanufacture Notice) Substance)

Molecular Formula

  • C13-H16-O3

Molecular Weight

  • 220.2664
 
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Names and Synonyms

Synonym

  • EINECS 279-400-4

Systematic Names

  • 1,3-Dimethyl-3-butenyl salicylate
  • Benzoic acid, 2-hydroxy-, 1,3-dimethyl-3-buten-1-yl ester
  • Benzoic acid, 2-hydroxy-, 1,3-dimethyl-3-butenyl ester

Registry Numbers

CAS Registry Number

  • 80118-10-1

System Generated Number

  • 0080118101

Structure Descriptors

InChI

1S/C13H16O3/c1-9(2)8-10(3)16-13(15)11-6-4-5-7-12(11)14/h4-7,10,14H,1,8H2,2-3H3

InChIKey

VBOJHXQVOIZGQO-UHFFFAOYSA-N

Smiles

CC(CC(=C)C)OC(=O)c1ccccc1O