SpectraBase Spectrum ID |
D1k8RWmtLAb |
Name |
(1S,5R)-8-Tosyl-8-azabicyclo[3.2.1]octan-2-one |
Appearance |
White solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C14H17NO3S |
InChI |
InChI=1S/C14H17NO3S/c1-10-2-6-12(7-3-10)19(17,18)15-11-4-8-13(15)14(16)9-5-11/h2-3,6-7,11,13H,4-5,8-9H2,1H3 |
InChIKey |
POCQDZQTWIVHNG-UHFFFAOYSA-N |
Instrument Name |
Agilent 7890A-5975C |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/anie.202000650 |
Molecular Weight |
279.354 g/mol |
Optical Rotation |
[a]D20 = -33.1 (c = 1.0, CH2Cl2) |
Reported Formula |
C14H17NO3S |
SMILES |
C12N(S(=O)(=O)c3ccc(cc3)C)C(CCC1=O)CC2 |
SPLASH |
splash10-00xr-9350000000-d2dc0467202fd6cc78cf |
Source of Spectrum |
ACI-59-SM46-SI-11 |
Thin-Layer Chromatography |
Rf = 0.29 (petroleum ether/EtOAc, 6:4) |
Wiley ID |
1857769 |