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CAS Number: 17610-21-8
1-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)ethanone

Structure

1-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)ethanone
Name: 1-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)ethanone
Synonyms:
General Information
Product Number: 17610218
CAS Registry Number: 17610-21-8
Name:
        Ethanone, 1-​(5,​6,​7,​8-​tetrahydro-​5,​5,​8,​8-​tetramethyl-​2-​naphthalenyl)​-
        2'-​Acetonaphthone, 5',​6',​7',​8'-​tetrahydro-​5',​5',​8',​8'-​tetramethyl- (7CI,​8CI); 1,​1,​4,​4-​Tetramethyl-​1,​2,​3,​4-​tetrahydro-​6-​acetylnaphthalene; 2-​Acetyl-​5,​6,​7,​8-​tetrahydro-​5,​5,​8,​8-​tetramethyl-​2-​naphthalene; 2-​Acetyl-​5,​6,​7,​8-​tetrahydro-​5,​5,​8,​8-​tetramethylnaphthale​ne; 5,​6,​7,​8-​Tetrahydro-​5,​5,​8,​8-​tetramethyl-​2-​acetylnaphthalene; 6-​Acetyl-​1,​2,​3,​4-​tetrahydro-​1,​1,​4,​4-​tetramethylnaphthale​ne 
 
Chemical Formula: C16H22O
Exact Mass: 230.17
Molecular Weight: 230.35
m/z: 230.17 (100.0%), 231.17 (17.6%), 232.17 (1.6%)
Elemental Analysis: C, 83.43; H, 9.63; O, 6.95
 
InChI: InChI=1S/C16H22O/c1-11(17)12-6-7-13-14(10-12)16(4,5)9-8-15(13,2)3/h6-7,10H,8-9H2,1-5H3
InChIKey: IHUSZOMIBSDQTB-UHFFFAOYSA-N
Canonical SMILES : CC(=O)C1=CC2=C(C=C1)C(CCC2(C)C)(C)C
 
Thermal Properties Value Condition Note
Melting Point 26-27 °C Solv: methanol (67-56-1) (1)CAS
 

Specification

98%

References
  1. (1) Buettner, Matthias W.; Organometallics 2007, V26(5), P1295-1298 CAPLUS
  2. (2) WSS: Spectral data were obtained from Wiley Subscription Services, Inc. (US)
  3. (3) Nakamura, Masahiko; Bioorganic & Medicinal Chemistry 2009, V17(13), P4740-4746 CAPLUS
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