| SpectraBase Spectrum ID |
58Sp5gDCAC |
| Name |
tert-Butyl(((1S,3aR,8aS)-7-Isopropyl-4-methyl-1,2,3,3a,6,8a-hexahydroazulen-1-yl)oxy)dimethylsilane |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
320.253542313 u |
| Formula |
C20H36OSi |
| InChI |
InChI=1S/C20H36OSi/c1-14(2)16-10-9-15(3)17-11-12-19(18(17)13-16)21-22(7,8)20(4,5)6/h9,13-14,17-19H,10-12H2,1-8H3/t17-,18-,19-/m0/s1 |
| InChIKey |
GCISJGOTHQPONT-FHWLQOOXSA-N |
| Instrument Name |
IT-MS Bruker AmaZon |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201607348 |
| Molecular Weight |
320.592 g/mol |
| Optical Rotation |
[a]D20.1 = -24.39 (c = 1.0, CHCl3) |
| Quality |
66 |
| Reported Formula |
C20H36OSi |
| SMILES |
C1C[C@@]([C@@]2([C@@]1(C(=CCC(=C2)C(C)C)C)[H])[H])(O[Si](C(C)(C)C)(C)C)[H] |
| SPLASH |
splash10-03fs-7970000000-4e78fe4f7fd2c2a2c62f |
| Sample Comments |
99.1% ee |
| Source of Spectrum |
ACI-55-SM7-3b (DOI: 10.1002/anie.201607348) |
| Thin-Layer Chromatography |
0.41 (Et2O/hexanes, 1%) |
| Wiley ID |
1899283 |
