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3-((9Z,12Z)-Heptadeca-9,12-dien-1-yl)phenol, tms

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3-((9Z,12Z)-Heptadeca-9,12-dien-1-yl)phenol, tms
SpectraBase Compound ID BuHm3iylekM
InChI InChI=1S/C26H44OSi/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-25-22-20-23-26(24-25)27-28(2,3)4/h8-9,11-12,20,22-24H,5-7,10,13-19,21H2,1-4H3/b9-8-,12-11-
InChIKey VZLBDOIMTDMFIO-MURFETPASA-N
Mol Weight 400.7 g/mol
Molecular Formula C26H44OSi
Exact Mass 400.316143 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1me6h2oN5zv
Name 3-((9Z,12Z)-Heptadeca-9,12-dien-1-yl)phenol, tms
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 400.316142571 u
Formula C26H44OSi
InChI InChI=1S/C26H44OSi/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-25-22-20-23-26(24-25)27-28(2,3)4/h8-9,11-12,20,22-24H,5-7,10,13-19,21H2,1-4H3/b9-8-,12-11-
InChIKey VZLBDOIMTDMFIO-MURFETPASA-N
Molecular Weight 400.722 g/mol
SMILES C1(=CC=CC(=C1)CCCCCCCC\C=C/C\C=C/CCCC)O[Si](C)(C)C