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2,3,5,6,8,9,11,12,14,15-Decahydro-1,4,7,10,13,16-benzohexaoxacyclooctadecine

View entire compound with spectra: 7 NMR, 3 FTIR, 1 Raman, and 4 MS (GC)

2,3,5,6,8,9,11,12,14,15-Decahydro-1,4,7,10,13,16-benzohexaoxacyclooctadecine
SpectraBase Compound ID GAGMxLhSWQA
InChI InChI=1S/C16H24O6/c1-2-4-16-15(3-1)21-13-11-19-9-7-17-5-6-18-8-10-20-12-14-22-16/h1-4H,5-14H2
InChIKey DSFHXKRFDFROER-UHFFFAOYSA-N
Mol Weight 312.36 g/mol
Molecular Formula C16H24O6
Exact Mass 312.157288 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L8K187DYbH6
Name 2,3,5,6,8,9,11,12,14,15-DECAHYDRO-1,4,7,10,13,16-BENZO-HEXAOXACYCLOOCTADECIN
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
CAS Registry Number 14098-24-9
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24O6
InChI InChI=1S/C16H24O6/c1-2-4-16-15(3-1)21-13-11-19-9-7-17-5-6-18-8-10-20-12-14-22-16/h1-4H,5-14H2
InChIKey DSFHXKRFDFROER-UHFFFAOYSA-N
Melting Point 44C
Molecular Weight 312.36
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms BENZOHEXAOXACYCLOOCTADECIN, 1,4,7,- 10,13,16-, 2,3,5,6,8,9,11,12,14,15- DECAHYDRO-, BENZO-18-CROWN-6