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(E)-14-METHOXY-[3-(TRIISOPROPYLSILYL)-PROP-2-YNYL]-3,4,5,6,7,10-HEXAHYDRO-1H-2-BENZOXACYCLODODECIN-1-ONE
SpectraBase Compound ID 3iu2SLL0x3q
InChI InChI=1S/C28H42O3Si/c1-21(2)32(22(3)4,23(5)6)20-14-18-25-17-12-10-8-9-11-15-24-16-13-19-26(30-7)27(24)28(29)31-25/h9,11,13,16,19,21-23,25H,8,10,12,15,17-18H2,1-7H3/b11-9+/t25-/m1/s1
InChIKey XHZBQQRGRQGPDA-VMQHTIDMSA-N
Mol Weight 454.7 g/mol
Molecular Formula C28H42O3Si
Exact Mass 454.290322 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A1LIWLGvYVX
Name 3-[3'-(Triisipropylsilyl)-2'-propynyl]-14-methoxy-(hexahydro-1H)-2-benzoxacyclododecin-1-one
Alternate Name(s) (3E,9R)-13-methoxy-9-[3-tri(propan-2-yl)silylprop-2-ynyl]-10-oxabicyclo[10.4.0]hexadeca-1(12),3,13,15-tetraen-11-one
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Formula C28H42O3Si
InChI InChI=1S/C28H42O3Si/c1-21(2)32(22(3)4,23(5)6)20-14-18-25-17-12-10-8-9-11-15-24-16-13-19-26(30-7)27(24)28(29)31-25/h9,11,13,16,19,21-23,25H,8,10,12,15,17-18H2,1-7H3/b11-9+/t25-/m1/s1
InChIKey XHZBQQRGRQGPDA-VMQHTIDMSA-N
Molecular Weight 454.726 g/mol
SMILES C1(c2c(OC)cccc2C\C=C\CCCC[C@@](O1)(CC#C[Si](C(C)C)(C(C)C)C(C)C)[H])=O
SPLASH splash10-03di-2713900000-8038733e7694f8684732
Source of Spectrum K1-2007-83-12
Wiley ID 1638986