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2-Bromanyl-8,9-di(propan-2-yloxy)-3,4,5,6-tetrahydro-2H-cyclobuta[l]phenanthren-1-one
SpectraBase Compound ID JRTft6Wslx8
InChI InChI=1S/C22H25BrO3/c1-11(2)25-17-9-15-13-7-5-6-8-14(13)19-20(22(24)21(19)23)16(15)10-18(17)26-12(3)4/h9-12,21H,5-8H2,1-4H3
InChIKey VEYYGKIALIUFMW-UHFFFAOYSA-N
Mol Weight 417.34 g/mol
Molecular Formula C22H25BrO3
Exact Mass 416.098708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9WckXVMOJ6G
Name 2-Bromanyl-8,9-di(propan-2-yloxy)-3,4,5,6-tetrahydro-2H-cyclobuta[l]phenanthren-1-one
Alternate Name(s) 2-Bromo-8,9-di(propan-2-yloxy)-3,4,5,6-tetrahydro-2H-cyclobuta[l]phenanthren-1-one 2-Bromo-8,9-diisopropoxy-3,4,5,6-tetrahydro-2H-cyclobuta[l]phenanthren-1-one
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Formula C22H25BrO3
InChI InChI=1S/C22H25BrO3/c1-11(2)25-17-9-15-13-7-5-6-8-14(13)19-20(22(24)21(19)23)16(15)10-18(17)26-12(3)4/h9-12,21H,5-8H2,1-4H3
InChIKey VEYYGKIALIUFMW-UHFFFAOYSA-N
Molecular Weight 417.343 g/mol
SMILES c12c(c3CCCCc3c3c2cc(c(OC(C)C)c3)OC(C)C)C(C1=O)Br
SPLASH splash10-014i-0091800000-980da9c6224ae9659f0a
Source of Spectrum J-63-1957-9
Wiley ID 1376316