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4-Undecenal, 3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-11-[3-(2,5-dimethyl-1H-pyrrol-1-yl)-2,5-dimethoxyphenyl]-7,8,11-trimethoxy-2,4,6,10-tetramethyl-, [2R-(2R*,3R*,4E,6S*,7R*,8S*,10S*,11R*)]-
SpectraBase Compound ID 7Xfb39s5AYb
InChI InChI=1S/C38H63NO7Si/c1-24(34(27(4)23-40)46-47(15,16)38(7,8)9)19-25(2)36(44-13)33(42-11)20-26(3)35(43-12)31-21-30(41-10)22-32(37(31)45-14)39-28(5)17-18-29(39)6/h17-19,21-23,25-27,33-36H,20H2,1-16H3/b24-19+/t25-,26-,27-,33-,34-,35+,36+/m0/s1
InChIKey OJJHKXMTTOHNHG-NBZIXWNOSA-N
Mol Weight 674.0 g/mol
Molecular Formula C38H63NO7Si
Exact Mass 673.43738 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID InOWploaBy4
Name 4-Undecenal, 3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-11-[3-(2,5-dimethyl-1H-pyrrol-1-yl)-2,5-dimethoxyphenyl]-7,8,11-trimethoxy-2,4,6,10-tetramethyl-, [2R-(2R*,3R*,4E,6S*,7R*,8S*,10S*,11R*)]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 673.437379901 u
Formula C38H63NO7Si
InChI InChI=1S/C38H63NO7Si/c1-24(34(27(4)23-40)46-47(15,16)38(7,8)9)19-25(2)36(44-13)33(42-11)20-26(3)35(43-12)31-21-30(41-10)22-32(37(31)45-14)39-28(5)17-18-29(39)6/h17-19,21-23,25-27,33-36H,20H2,1-16H3/b24-19+/t25-,26-,27-,33-,34-,35+,36+/m0/s1
InChIKey OJJHKXMTTOHNHG-NBZIXWNOSA-N
Molecular Weight 674.007 g/mol
SMILES C1(N2C(=CC=C2C)C)=C(C([C@@]([C@](C[C@@]([C@@]([C@](\C=C\([C@](O[Si](C(C)(C)C)(C)C)([C@](C=O)(C)[H])[H])C)(C)[H])(OC)[H])(OC)[H])(C)[H])(OC)[H])=CC(=C1)OC)OC