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4-[(3Z,5E,7E)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-[(E)-2-phenylethenyl]-2H-azocin-7-yl]-2-methyl-4-oxobutanoic acid butyl ester
SpectraBase Compound ID KSw6C2BBOOo
InChI InChI=1S/C31H45NO4Si/c1-8-9-21-35-30(34)25(2)22-29(33)28-23-32(20-18-26-15-11-10-12-16-26)19-14-13-17-27(28)24-36-37(6,7)31(3,4)5/h10-18,20,23,25H,8-9,19,21-22,24H2,1-7H3/b14-13-,20-18+,27-17-,28-23+
InChIKey RRPLUOSNIUFVPW-KCLNPSSASA-N
Mol Weight 523.8 g/mol
Molecular Formula C31H45NO4Si
Exact Mass 523.311785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EPGgrRfmyqo
Name 4-[(3Z,5E,7E)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-[(E)-2-phenylethenyl]-2H-azocin-7-yl]-2-methyl-4-oxobutanoic acid butyl ester
CAS Registry Number 83253-66-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H45NO4Si
InChI InChI=1S/C31H45NO4Si/c1-8-9-21-35-30(34)25(2)22-29(33)28-23-32(20-18-26-15-11-10-12-16-26)19-14-13-17-27(28)24-36-37(6,7)31(3,4)5/h10-18,20,23,25H,8-9,19,21-22,24H2,1-7H3/b14-13-,20-18+,27-17-,28-23+
InChIKey RRPLUOSNIUFVPW-KCLNPSSASA-N
Molecular Weight 523.789 g/mol
SMILES C(\C1=C\N(\C=C\c2ccccc2)C\C=C/C=C\1CO[Si](C(C)(C)C)(C)C)(CC(C(=O)OCCCC)C)=O
SPLASH splash10-00b9-9100100000-523954e669a2b85f689e
Source of Spectrum F-38-1590-0
Synonyms 4-[(3Z,5E,7E)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-[(E)-styryl]-2H-azocin-7-yl]-4-keto-2-methyl-butyric acid butyl ester Butyl 4-[(3Z,5E,7E)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-[(E)-2-phenylethenyl]-2H-azocin-7-yl]-2-methyl-4-oxidanylidene-butanoate Butyl 4-[(3Z,5E,7E)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-[(E)-2-phenylethenyl]-2H-azocin-7-yl]-2-methyl-4-oxobutanoate Butyl 4-[(3Z,5E,7E)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-[(E)-styryl]-2H-azocin-7-yl]-2-methyl-4-oxo-butanoate
Wiley ID 1402414