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2,3,5,6,8,9,11,12,14,15-DECAHYDRO-18-NITRO-1,4,7,10,13,16-BENZOHEXAOXACYCLOOCTADECIN

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2,3,5,6,8,9,11,12,14,15-DECAHYDRO-18-NITRO-1,4,7,10,13,16-BENZOHEXAOXACYCLOOCTADECIN
SpectraBase Compound ID C7Dke2VAFyl
InChI InChI=1S/C16H23NO8/c18-17(19)14-1-2-15-16(13-14)25-12-10-23-8-6-21-4-3-20-5-7-22-9-11-24-15/h1-2,13H,3-12H2
InChIKey LQXOKBZWNFJJGI-UHFFFAOYSA-N
Mol Weight 357.36 g/mol
Molecular Formula C16H23NO8
Exact Mass 357.142367 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LLSgpQvDOO0
Name 2,3,5,6,8,9,11,12,14,15-DECAHYDRO-18-NITRO-1,4,7,10,13,16-BENZOHEXAOXACYCLOOCTADECIN
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
CAS Registry Number 53408-96-1
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23NO8
InChI InChI=1S/C16H23NO8/c18-17(19)14-1-2-15-16(13-14)25-12-10-23-8-6-21-4-3-20-5-7-22-9-11-24-15/h1-2,13H,3-12H2
InChIKey LQXOKBZWNFJJGI-UHFFFAOYSA-N
Melting Point 86C
Molecular Weight 357.36
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms BENZO-18-CROWN-6, 4'-NITRO-, BENZOHEXAOXACYCLOOCTADECIN, 1,4,7,- 10,13,16-, 2,3,5,6,8,9,11,12,14,15- DECAHYDRO-18-NITRO-,