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Substance Name: 1-Benzyloxy-4,8,11,11-tetramethyl-6-phenylthiobicyclo(5.3.1)undec-7-en-3-one
RN: 129720-17-8
InChIKey: WWPVSSBILGYJRZ-HPKXWHFBSA-N

Molecular Formula

  • C28-H34-O2-S

Molecular Weight

  • 434.6406
 
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Names and Synonyms

Name of Substance

  • 1-Benzyloxy-4,8,11,11-tetramethyl-6-phenylthiobicyclo(5.3.1)undec-7-en-3-one

Synonyms

  • (4-endo,6-exo)-(+-)-4,8,11,11-Tetramethyl-1-(phenylmethoxy)-6-(phenylthio)bicyclo(5.3.1)undec-7-en-3-one
  • BTPBU

Systematic Name

  • Bicyclo(5.3.1)undec-7-en-3-one, 4,8,11,11-tetramethyl-1-(phenylmethoxy)-6-(phenylthio)-, (4-endo,6-exo)-(+-)-

Registry Numbers

CAS Registry Number

  • 129720-17-8

System Generated Number

  • 0129720178

Structure Descriptors

InChI

1S/C28H34O2S/c1-20-15-16-28(30-19-22-11-7-5-8-12-22)18-24(29)21(2)17-25(26(20)27(28,3)4)31-23-13-9-6-10-14-23/h5-14,21,25H,15-19H2,1-4H3/t21-,25-,28+/m0/s1

InChIKey

WWPVSSBILGYJRZ-HPKXWHFBSA-N

Smiles

C[C@H]1C[C@@H](C2=C(CC[C@](C2(C)C)(CC1=O)OCc3ccccc3)C)Sc4ccccc4