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Substance Name: beta-Bourbonene
RN: 5208-59-3
UNII: KIZ51R7NTL
InChIKey: YIRAHEODBQONHI-ZQNQSHIBSA-N

Note

  • Organic volatile isolated from nonpareil almonds, Prunus dulcis.

Molecular Formula

  • C15-H24

Molecular Weight

  • 204.355
 
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Names and Synonyms

Results Name

  • beta-Bourbonene

Name of Substance

  • beta-Bourbonene

Synonyms

  • (-)-beta-Bourbonene
  • 1,2,3,3a,3bbeta,4,5,6,6abeta,6balpha-decahydro-1alpha-isopropyl-3aalpha-methyl-6-methylenecyclobuta(1,2:3,4)dicyclopentene
  • beta-Bourbonene
  • Cyclobuta(1,2:3,4)dicyclopentene, 1,2,3,3a,3bbeta,4,5,6,6abeta,6balpha-decahydro-1alpha-isopropyl-3aalpha-methyl-6-methylene
  • Cyclobuta(1,2:3,4)dicyclopentene, decahydro-3a-methyl-6-methylene-1-(1-methylethyl)-, (1S-(1alpha,3aalpha,3bbeta,6abeta,6balpha))-
  • Decahydro-3a-methyl-6-methylene-1-(1-methylethyl)cyclobuta(1,2:3,4)dicyclopentene, (1S-(1alpha,3aalpha,3bbeta,6abeta,6balpha))-
  • Decahydroisopropylmethylmethylenecyclobuta(1,2:3,4)dicyclopentene
  • UNII-KIZ51R7NTL

Systematic Name

  • Cyclobuta(1,2:3,4)dicyclopentene, decahydro-3a-methyl-6-methylene-1-(1-methylethyl)-, (1S-(1alpha,3aalpha,3bbeta,6abeta,6balpha))-

Superlist Name

  • Bourbonene, beta-

Registry Numbers

CAS Registry Number

  • 5208-59-3

FDA UNII

  • KIZ51R7NTL

Other Registry Number

  • 13833-27-7

System Generated Number

  • 0005208593

Structure Descriptors

InChI

1S/C15H24/c1-9(2)11-7-8-15(4)12-6-5-10(3)13(12)14(11)15/h9,11-14H,3,5-8H2,1-2,4H3/t11-,12+,13-,14+,15-/m0/s1

InChIKey

YIRAHEODBQONHI-ZQNQSHIBSA-N

Smiles

C1C([C@@H]2[C@H]3[C@H](C(C)C)CC[C@@]3([C@H]2C1)C)=C