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1,4,7,10,13-Pentaoxacyclohexadecan-15-ol, 2-(phenoxymethyl)-

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

1,4,7,10,13-Pentaoxacyclohexadecan-15-ol, 2-(phenoxymethyl)-
SpectraBase Compound ID 8336CG6oGZT
InChI InChI=1S/C18H28O7/c19-16-12-22-10-8-20-6-7-21-9-11-23-14-18(24-13-16)15-25-17-4-2-1-3-5-17/h1-5,16,18-19H,6-15H2
InChIKey ATSAXVMMJZMVOC-UHFFFAOYSA-N
Mol Weight 356.42 g/mol
Molecular Formula C18H28O7
Exact Mass 356.183503 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KohiUkG7YDu
Name 1,4,7,10,13-Pentaoxacyclohexadecan-15-ol, 2-(phenoxymethyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 356.183503235 u
Formula C18H28O7
InChI InChI=1S/C18H28O7/c19-16-12-22-10-8-20-6-7-21-9-11-23-14-18(24-13-16)15-25-17-4-2-1-3-5-17/h1-5,16,18-19H,6-15H2
InChIKey ATSAXVMMJZMVOC-UHFFFAOYSA-N
Molecular Weight 356.415 g/mol
SMILES C1(OCC(COCCOCCOCCOC1)O)COC=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.878234