Chem
J-GLOBAL ID:200907053052116321
Nikkaji number:J1.555.801F
(9Z)-1-(Benzoxazole-2-yl)-2,2-dimethyl-9-octadecene-1-one
(9Z)-1-(ベンゾオキサゾール-2-イル)-2,2-ジメチル-9-オクタデセン-1-オン
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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:
C27 H41 NO2
Molecular formula furigana:
C27-H41-N-O2
Molecular weight:
411.630
InChI:
InChI=1S/C27H41NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-27(2,3)25(29)26-28-23-20-17-18-21-24(23)30-26/h11-12,17-18,20-21H,4-10,13-16,19,22H2,1-3H3/b12-11-
InChI key:
MVCOTBPZLONRSJ-QXMHVHEDSA-N
SMILES:
CCCCCCCC/C=C\CCCCCCC(C)(C)C(=O)c1nc2ccccc2o1
Systematic name (3):
(9Z)-1-(ベンゾオキサゾール-2-イル)-2,2-ジメチル-9-オクタデセン-1-オン
(9Z)-1-(1,3-ベンゾオキサゾール-2-イル)-2,2-ジメチルオクタデカ-9-エン-1-オン
(9Z)-1-(1,3-benzoxazol-2-yl)-2,2-dimethyloctadec-9-en-1-one
Other name (1):
(9Z)-1-(Benzoxazole-2-yl)-2,2-dimethyl-9-octadecene-1-one
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