| SpectraBase Spectrum ID |
AfSZiBzinwq |
| Name |
(S)-3-((1R,4S)-4,7-Dimethyl-1,2,3,4-tetrahydronaphthalene-1-yl)-butane-1-ol |
| Appearance |
Colorless oil |
| Carrier Gas |
Hydrogen (1.7 ml/min, 1.2 bar) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
232.182715392 u |
| Formula |
C16H24O |
| GC Column |
Optima-1-MS (30 m x 0.25 mm) |
| GC Oven Program |
Oven temp 300oC |
| InChI |
InChI=1S/C16H24O/c1-11-4-6-14-12(2)5-7-15(16(14)10-11)13(3)8-9-17/h4,6,10,12-13,15,17H,5,7-9H2,1-3H3/t12-,13-,15+/m0/s1 |
| InChIKey |
XQQPEGGCILEVER-KCQAQPDRSA-N |
| Instrument Name |
Agilent GC6890-HP 5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202101863 |
| Molecular Weight |
232.367 g/mol |
| Optical Rotation |
[a]lambda20 = 56.4 (436 nm), 37.0 (546 nm), 33.6 (579 nm), 32.0 (589 nm) (c = 0.55 g/100 ml, CHCl3) |
| Quality |
98 |
| SMILES |
OCC[C@@]([C@@]1(C2=C(C=CC(=C2)C)[C@](CC1)(C)[H])[H])(C)[H] |
| SPLASH |
splash10-0a4i-0910000000-bc3f795ef228aca32712 |
| Source of Spectrum |
QE-27-SM20-15a (DOI: 10.1002/chem.202101863) |
| Thin-Layer Chromatography |
0.22 (CyHex/EtOAc, 5:1) |
| Wiley ID |
1902156 |
