Search Result : Detailed Informations

Low Mol Weight Allergen Name CAS# CID
Acetyl Hexamethyl Tetralin 1506-02-1 89440

Structure Other Information
Canonical SMILES CC1CC(C2=C(C1(C)C)C=C(C(=C2)C(=O)C)C)(C)C
Iso SMILES CC1CC(C2=C(C1(C)C)C=C(C(=C2)C(=O)C)C)(C)C
InChI InChI=1S/C18H26O/c1-11-8-16-15(9-14(11)13(3)19)17(4,5)10-12(2)18(16,6)7/h8-9,12H,10H2,1-7H3
InChI Key DNRJTBAOUJJKDY-UHFFFAOYSA-N
Formula C18H26O
Mol Weight 258.398
XlogP3 5.3
Charge 0

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Synonyms Information
CAS Name 1-(3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)ethanone
IUPAC Name 1-(1,1,2,4,4,7-hexamethyltetralin-6-yl)ethanone
Openeye Name 1-(3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)ethanone
Systematic Name 1-(3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)ethanone
Tratitional Name 1-(3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)ethanone