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2-Chloro-6,7,9,10,12,13-hexahydro-19H-dibenzo[k,n][1,4,7,10,13]tetraoxazacyclopentadecine

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2-Chloro-6,7,9,10,12,13-hexahydro-19H-dibenzo[k,n][1,4,7,10,13]tetraoxazacyclopentadecine
SpectraBase Compound ID KSd11lEEP6k
InChI InChI=1S/C18H20ClNO4/c19-14-5-6-18-16(13-14)20-15-3-1-2-4-17(15)23-11-9-21-7-8-22-10-12-24-18/h1-6,13,20H,7-12H2
InChIKey SXVZAELNIWJVQJ-UHFFFAOYSA-N
Mol Weight 349.81 g/mol
Molecular Formula C18H20ClNO4
Exact Mass 349.108086 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AkL2Psr0Azm
Name 2-Chloro-6,7,9,10,12,13-hexahydro-19H-dibenzo[K,N][1,4,7,10,13]tetraoxazacyclopentadecine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 349.108085824 u
Formula C18H20ClNO4
InChI InChI=1S/C18H20ClNO4/c19-14-5-6-18-16(13-14)20-15-3-1-2-4-17(15)23-11-9-21-7-8-22-10-12-24-18/h1-6,13,20H,7-12H2
InChIKey SXVZAELNIWJVQJ-UHFFFAOYSA-N
Molecular Weight 349.814 g/mol
SMILES C=12NC=3C(OCCOCCOCCOC1C=CC(=C2)Cl)=CC=CC3