| SpectraBase Spectrum ID |
itSK8pko3l |
| Name |
(-)-1,7,7-Trimethyl-2-(thiazol-2-yl)bicyclo[2.2.1]heptan-2-ol |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H19NOS |
| InChI |
InChI=1S/C13H19NOS/c1-11(2)9-4-5-12(11,3)13(15,8-9)10-14-6-7-16-10/h6-7,9,15H,4-5,8H2,1-3H3/t9-,12-,13+/m0/s1 |
| InChIKey |
GNSPSGHQRQZDLA-TVYUQYBPSA-N |
| Instrument Name |
Finnigan MAT 95Q or Finnigan MAT 90 or JEOL JMS-700 |
| Ionization Type |
EI pos |
| Literature Reference DOI |
10.1002/anie.201810327 |
| Molecular Weight |
237.361 g/mol |
| Optical Rotation |
[a]D22= -57.28 (b = 1.10, CH2Cl2) |
| Reported Formula |
C13H19NOS |
| SMILES |
O[C@]1(C[C@]2(C([C@@]1(CC2)C)(C)C)[H])c1sccn1 |
| SPLASH |
splash10-004s-8920000000-8fab71bfd1cc840bba53 |
| Sample Comments |
dr > 99:1 |
| Source of Spectrum |
ACI-58-SM46-12a |
| Thin-Layer Chromatography |
Rf = 0.56 (hexane/EtOAc 80:20, UV, KMnO4, PAA) |
| Wiley ID |
1840503 |
![(-)-1,7,7-Trimethyl-2-(thiazol-2-yl)bicyclo[2.2.1]heptan-2-ol](/api/spectrum/itSK8pko3l/structure.png?h=300&w=458 "(-)-1,7,7-Trimethyl-2-(thiazol-2-yl)bicyclo[2.2.1]heptan-2-ol")
