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1-[2-({2-[1-(Acetyloxy)-2-cyanoethyl]phenyl}ethynyl)phenyl]-4-(trimethylsilyl)-but-3-yn-yl-acetate
SpectraBase Compound ID FiNW6zUu0qZ
InChI InChI=1S/C28H29NO4Si/c1-21(30)32-27(15-10-20-34(3,4)5)25-13-8-6-11-23(25)16-17-24-12-7-9-14-26(24)28(18-19-29)33-22(2)31/h6-9,11-14,27-28H,15,18H2,1-5H3
InChIKey JMZMKZJHZXSEAZ-UHFFFAOYSA-N
Mol Weight 471.63 g/mol
Molecular Formula C28H29NO4Si
Exact Mass 471.186585 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4WTWvDRor0s
Name 1-[2-({2-[1-(Acetyloxy)-2-cyanoethyl]phenyl}ethynyl)phenyl]-4-(trimethylsilyl)-but-3-yn-yl-acetate
Appearance Oil
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Exact Mass 471.186584949 u
Formula C28H29NO4Si
InChI InChI=1S/C28H29NO4Si/c1-21(30)32-27(15-10-20-34(3,4)5)25-13-8-6-11-23(25)16-17-24-12-7-9-14-26(24)28(18-19-29)33-22(2)31/h6-9,11-14,27-28H,15,18H2,1-5H3
InChIKey JMZMKZJHZXSEAZ-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201602747
Molecular Weight 471.628 g/mol
Quality 224
Reported Formula C28H29NO4Si
SMILES C(#C[Si](C)(C)C)CC(C1=C(C=CC=C1)C#CC1=CC=CC=C1C(OC(C)=O)CC#N)OC(C)=O
SPLASH splash10-0pb9-4092000000-0c426aa181e5497d3e82
Source of Spectrum QE-22-SM13-17 (DOI: 10.1002/chem.201602747)
Wiley ID 1905110