Chem
J-GLOBAL ID:201607004781239810
Nikkaji number:J3.513.243K
1-(Tricyclo[8.2.2.24,7 ]hexadecane-1(12),4,6,10,13,15-hexaene-5-yl)-2-bromoethanone
1-(トリシクロ[8.2.2.24,7 ]ヘキサデカン-1(12),4,6,10,13,15-ヘキサエン-5-イル)-2-ブロモエタノン
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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:
C18 H17 BrO
Molecular formula furigana:
C18-H17-BR-O
Molecular weight:
329.237
InChI:
InChI=1S/C18H17BrO/c19-12-18(20)17-11-15-6-5-13-1-3-14(4-2-13)7-9-16(17)10-8-15/h1-4,8,10-11H,5-7,9,12H2
InChI key:
YHTZBTBMDMIXTF-UHFFFAOYSA-N
SMILES:
BrCC(=O)c1cc2CCc3ccc(CCc1cc2)cc3
Systematic name (3):
1-(トリシクロ[8.2.2.24,7 ]ヘキサデカン-1(12),4,6,10,13,15-ヘキサエン-5-イル)-2-ブロモエタノン
2-ブロモ-1-{トリシクロ[8.2.2.24,7 ]ヘキサデカ-1(12),4(16),5,7(15),10,13-ヘキサエン-5-イル}エタン-1-オン
2-bromo-1-{tricyclo[8.2.2.24,7 ]hexadeca-1(12),4(16),5,7(15),10,13-hexaen-5-yl}ethan-1-one
Other name (1):
1-(Tricyclo[8.2.2.24,7 ]hexadecane-1(12),4,6,10,13,15-hexaene-5-yl)-2-bromoethanone
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