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Substance Name: Isovellerol
RN: 96910-70-2
InChIKey: MRWQPWOAWYZTBU-DZGBDDFRSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C15-H22-O2

Molecular Weight

  • 234.337
 
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Names and Synonyms

Results Name

  • Isovellerol

Synonyms

  • BRN 5479902
  • CCRIS 1714
  • Isovellerol

Systematic Names

  • Cycloprop(e)indene-1a(1H)-carboxaldehyde, 3a,4,5,6,6a,6b-hexahydro-2-(hydroxymethyl)-5,5,6b-trimethyl-, (1aS-(1a-alpha,3a-beta,6a-beta,6b-alpha))-
  • Isovellerol

Registry Numbers

CAS Registry Number

  • 96910-70-2

System Generated Number

  • 0096910702

Structure Descriptors

InChI

1S/C15H22O2/c1-13(2)5-10-4-11(7-16)15(9-17)8-14(15,3)12(10)6-13/h4,9-10,12,16H,5-8H2,1-3H3/t10-,12+,14-,15-/m1/s1

InChIKey

MRWQPWOAWYZTBU-DZGBDDFRSA-N

Smiles

C1[C@@]2([C@@]1([C@@H]1[C@@H](CC(C1)(C)C)C=C2CO)C)C=O