| SpectraBase Spectrum ID |
6TI9hEQLhSu |
| Name |
N-((1R,4s,7S)-4-Benzyl-8-oxabicyclo[5.1.0]octan-4-yl)-4-methylbenzenesulfonamide |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H25NO3S |
| InChI |
InChI=1S/C21H25NO3S/c1-16-7-9-18(10-8-16)26(23,24)22-21(15-17-5-3-2-4-6-17)13-11-19-20(25-19)12-14-21/h2-10,19-20,22H,11-15H2,1H3/t19-,20+,21- |
| InChIKey |
ACMJYZVXYMJAKM-WKCHPHFGSA-N |
| Instrument Name |
Agilent 7890A-5975C |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202000650 |
| Molecular Weight |
371.495 g/mol |
| Reported Formula |
C21H25NO3S |
| SMILES |
N(S(=O)(=O)c1ccc(cc1)C)[C@]1(Cc2ccccc2)CC[C@]2([C@@](CC1)(O2)[H])[H] |
| SPLASH |
splash10-014l-7392000000-965fecfc4900a31edaee |
| Sample Comments |
mixture of diastereoisomers (trans/cis, 1.2:1) |
| Source of Spectrum |
ACI-59-SM30-1f |
| Wiley ID |
1857736 |
![N-((1R,4s,7S)-4-Benzyl-8-oxabicyclo[5.1.0]octan-4-yl)-4-methylbenzenesulfonamide](/api/spectrum/6TI9hEQLhSu/structure.png?h=300&w=458 "N-((1R,4s,7S)-4-Benzyl-8-oxabicyclo[5.1.0]octan-4-yl)-4-methylbenzenesulfonamide")
