Chem
J-GLOBAL ID:200907059814992823
Nikkaji number:J9.661J
α-Vetivone
α-ベチボン
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C15 H22 O
Molecular formula furigana:
C15-H22-O
Molecular weight:
218.340
InChI:
InChI=1S/C15H22O/c1-10(2)12-5-6-13-8-14(16)7-11(3)15(13,4)9-12/h8,11H,5-7,9H2,1-4H3/t11-,15+/m1/s1
InChI key:
NIIPDXITZPFFTE-ABAIWWIYSA-N
SMILES:
C[C@@H]1CC(=O)C=C2CCC(=C(C)C)C[C@@]12C
Systematic name (5):
(4R,4aS)-4,4a,5,6,7,8-ヘキサヒドロ-4,4a-ジメチル-6-(1-メチルエチリデン)ナフタレン-2(3H)-オン
(4R)-4,4a,5,6,7,8-ヘキサヒドロ-4β,4aβ-ジメチル-6-(1-メチルエチリデン)ナフタレン-2(3H)-オン
4β,4aβ-ジメチル-6-イソプロピリデン-4,4a,5,6,7,8-ヘキサヒドロナフタレン-2(3H)-オン
(4R,4aS)-4,4a-ジメチル-6-(プロパン-2-イリデン)-2,3,4,4a,5,6,7,8-オクタヒドロナフタレン-2-オン
(4R,4aS)-4,4a-dimethyl-6-(propan-2-ylidene)-2,3,4,4a,5,6,7,8-octahydronaphthalen-2-one
Other name (9):
α-ベチボン
イソノオトカトン
α-Vetivone
Isonootkatone
(4R)-4,4a,5,6,7,8-Hexahydro-4β,4aβ-dimethyl-6-(1-methylethylidene)naphthalen-2(3H)-one
(4R,4aS)-4,4a,5,6,7,8-Hexahydro-4,4a-dimethyl-6-(1-methylethylidene)naphthalen-2(3H)-one
(+)-α-ベチボン
4β,4aβ-Dimethyl-6-isopropylidene-4,4a,5,6,7,8-hexahydronaphthalene-2(3H)-one
(+)-α-Vetivone
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CAS registry number:
15764-04-2
Regulation number (2):
EINECS2398551
TSCA(15764-04-2)
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