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butyl (1S,5R,7R)-4-oxo-3-(2-phenylethyl)-10-oxa-3-azatricyclo[5.2.1.0~1,5~]dec-8-ene-6-carboxylate
SpectraBase Compound ID 91c1JZEXMt3
InChI InChI=1S/C21H25NO4/c1-2-3-13-25-20(24)17-16-9-11-21(26-16)14-22(19(23)18(17)21)12-10-15-7-5-4-6-8-15/h4-9,11,16-18H,2-3,10,12-14H2,1H3
InChIKey BJLOPVKFECOISX-UHFFFAOYSA-N
Mol Weight 355.43 g/mol
Molecular Formula C21H25NO4
Exact Mass 355.178358 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DcHEsfhI8jH
Name butyl (1S,5R,7R)-4-oxo-3-(2-phenylethyl)-10-oxa-3-azatricyclo[5.2.1.0~1,5~]dec-8-ene-6-carboxylate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H25NO4/c1-2-3-13-25-20(24)17-16-9-11-21(26-16)14-22(19(23)18(17)21)12-10-15-7-5-4-6-8-15/h4-9,11,16-18H,2-3,10,12-14H2,1H3
InChIKey BJLOPVKFECOISX-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_7572
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D48135; Labnumber: LGV-1803; SBI_ID: SBI-007575
Synonyms butyl 4-oxo-3-(2-phenylethyl)-10-oxa-3-azatricyclo[5.2.1.0~1,5~]dec-8-ene-6-carboxylate
Temperature 318 °C