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5-(cyclohex-1-en-1-ylcarbonyl)-7-hydroxy-1,1-dimethyl-3-(propan-2-yl)-2,3-dihydro-1H-inden-4-yl borodifluoridate
SpectraBase Compound ID 8JWvmIpoVYA
InChI InChI=1S/C21H27BF2O3/c1-12(2)15-11-21(3,4)18-16(25)10-14(20(17(15)18)27-22(23)24)19(26)13-8-6-5-7-9-13/h8,10,12,15,25H,5-7,9,11H2,1-4H3
InChIKey YAMQCDBQWBIEMH-UHFFFAOYSA-N
Mol Weight 376.3 g/mol
Molecular Formula C21H27BF2O3
Exact Mass 376.202131 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EdTJsZYdqEp
Name 5-(cyclohex-1-en-1-ylcarbonyl)-7-hydroxy-1,1-dimethyl-3-(propan-2-yl)-2,3-dihydro-1H-inden-4-yl borodifluoridate
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Formula C21H27BF2O3
InChI InChI=1S/C21H27BF2O3/c1-12(2)15-11-21(3,4)18-16(25)10-14(20(17(15)18)27-22(23)24)19(26)13-8-6-5-7-9-13/h8,10,12,15,25H,5-7,9,11H2,1-4H3
InChIKey YAMQCDBQWBIEMH-UHFFFAOYSA-N
Molecular Weight 376.251 g/mol
SMILES Oc1c2C(CC(C(C)C)c2c(c(c1)C(=O)C1=CCCCC1)OB(F)F)(C)C
SPLASH splash10-0059-2129000000-3277c8e0d94820b0668d
Source of Spectrum JX-2015-3-1606
Synonyms Cyclohex-1-en-1-yl(4-((difluoroboryl)oxy)-7-hydroxy-3-isopropyl-1,1-dimethyl-2,3-dihydro-1H-inden-5-yl)methanone 1-Cyclohexenyl-(4-difluoroboranyloxy-7-hydroxy-1,1-dimethyl-3-propan-2-yl-2,3-dihydroinden-5-yl)methanone Cyclohexen-1-yl-(4-difluoroboranyloxy-7-hydroxy-1,1-dimethyl-3-propan-2-yl-2,3-dihydroinden-5-yl)methanone [4-bis(fluoranyl)boranyloxy-1,1-dimethyl-7-oxidanyl-3-propan-2-yl-2,3-dihydroinden-5-yl]-(cyclohexen-1-yl)methanone
Wiley ID 1725085