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Substance Name: alpha, beta-Thujone
RN: 76231-76-0
UNII: 86HK1QRJ4K
InChIKey: USMNOWBWPHYOEA-VWHDNNRLSA-N

Molecular Formula

  • C10-H16-O

Molecular Weight

  • 152.2354
 
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Names and Synonyms

Name of Substance

  • alpha, beta-Thujone
  • Thujone

Synonyms

  • alpha,beta-Thujone
  • HSDB 8144
  • UNII-86HK1QRJ4K

Registry Numbers

CAS Registry Number

  • 76231-76-0

FDA UNII

  • 86HK1QRJ4K

System Generated Number

  • 0076231760

Structure Descriptors

InChI

1S/C10H16O/c1-6(2)10-4-8(10)7(3)9(11)5-10/h6-8H,4-5H2,1-3H3/t7?,8-,10+/m1/s1

InChIKey

USMNOWBWPHYOEA-VWHDNNRLSA-N

Smiles

CC1[C@H]2C[C@]2(CC1=O)C(C)C