Kessane

  • Identifiers

    CAS number
    3321-66-2

    Molecular formula
    C15H26O

    SMILES
    C[C@@H]1CC[C@@H]2[C@@H]1C[C@H]3CC[C@@]2(OC3(C)C)C
    HHHHO

    Retention indicies (RI)

    • DB5: 1528.0

  • Odor profile

    woody 65.34%
    herbal 53.17%
    fresh 50.53%
    spicy 49.08%
    pine 42.28%
    camphoreous 40.8%
    sweet 39.91%
    dry 38.81%
    mint 38.6%
    amber 38.45%

    Scent© AI

  • Properties

    XLogP3-AA
    3.8 Well soluble in BB, DEP, IAA

    Molecular weight
    222.37 g/mol

  • Synonyms

    • Kessane
    • 3321-66-2
    • (1S,2R,5R,6R,8R)-1,5,9,9-tetramethyl-10-oxatricyclo[6.2.2.02,6]dodecane
    • 1,4-Ethano-1H-cyclopent(c)oxepin, octahydro-1,3,3,6-tetramethyl-, (1S-(1alpha,4alpha,5abeta,6alpha,8aalpha))-
    • DTXSID90186862
    • (1S,2R,5R,6R,8R)-1,5,9,9-tetramethyl-10-oxatricyclo(6.2.2.02,6)dodecane
    • DTXCID30109353
    • (1R,3aR,4S,7R,8aR)-1,4,9,9-Tetramethyldecahydro-4,7-(epoxymethano)azulene
    • 1,4-Ethano-1H-cyclopent(c)oxepin, octahydro-1,3,3,6-tetramethyl-, (1S,4R,5aR,6R,8aR)-
    • 1,4-Ethano-1H-cyclopent[c]oxepin, octahydro-1,3,3,6-tetramethyl-, (1S,4R,5aR,6R,8aR)-
NaN -Infinity

Botanical

Name CAS Botanical Proportion
Valeriana javanica root (Indonesia) Valeriana javanica Blume, fam. Valerianaceae 6.8%
Cymbopogon nardus, var. confertiflorus Cymbopogon naruds (L.) Rendle, var., confertiflorus (Steud.), fam. Poaceae 0.05%
Calamus (Bangladesh) root 8015-79-0 Acorus calamus L., fam. Araceae 0.06%
Vetiver (Haiti) 84238-29-9 Vetiveria zizanioides Stapf, fam. Poaceae (Gramineae) 0.1%
Celery seed (India) 5 8015-90-5 Apium graveolens L., fam. Apiaceae (Umbelliferae) 4.0%