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Truxilloyl/truxinoyl tms

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Truxilloyl/truxinoyl tms
SpectraBase Compound ID 4py443EeF2e
InChI InChI=1S/C31H39NO6Si/c1-32-21-16-17-22(32)26(29(33)36-2)23(18-21)37-30(34)27-24(19-12-8-6-9-13-19)28(31(35)38-39(3,4)5)25(27)20-14-10-7-11-15-20/h6-15,21-28H,16-18H2,1-5H3
InChIKey NJAWINCSBNZTLJ-UHFFFAOYSA-N
Mol Weight 549.7 g/mol
Molecular Formula C31H39NO6Si
Exact Mass 549.254665 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2xauvwxTubT
Name Truxilloyl/truxinoyl tms
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 549.254664509 u
Formula C31H39NO6Si
InChI InChI=1S/C31H39NO6Si/c1-32-21-16-17-22(32)26(29(33)36-2)23(18-21)37-30(34)27-24(19-12-8-6-9-13-19)28(31(35)38-39(3,4)5)25(27)20-14-10-7-11-15-20/h6-15,21-28H,16-18H2,1-5H3
InChIKey NJAWINCSBNZTLJ-UHFFFAOYSA-N
Molecular Weight 549.739 g/mol
SMILES C1(C(C(C1C(O[Si](C)(C)C)=O)C1=CC=CC=C1)C(OC1C(C2N(C(C1)CC2)C)C(OC)=O)=O)C1=CC=CC=C1