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Catalog | BBC76497693 |
CAS | 76497-69-3 |
Synonyms | 3-Buten-2-one, 4-[(1S,4aS,8aS)-decahydro-5,5,8a-trimethyl-2-methylene-1-naphthalenyl]-, (3E)- |
IUPAC Name | (E)-4-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one |
Molecular Weight | 260.41 |
Molecular Formula | C18H28O |
Canonical SMILES | CC(=O)/C=C/[C@H]1C(=C)CC[C@@H]2[C@@]1(CCCC2(C)C)C |
InChI | InChI=1S/C18H28O/c1-13-7-10-16-17(3,4)11-6-12-18(16,5)15(13)9-8-14(2)19/h8-9,15-16H,1,6-7,10-12H2,2-5H3/b9-8+/t15-,16-,18+/m0/s1 |
InChI Key | GWLGWWOKIBLQJF-YGUYEABBSA-N |
Boiling Point | 343.9±21.0 °C |
Melting Point | 146-147 °C |
Purity | 98% |
Density | 0.94±0.1 g/ml |
Appearance | Solid |
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