| SpectraBase Spectrum ID |
71DeEXgzeze |
| Name |
Benzyl (5R)-2-methyl-5-(thiophen-2-yl)-4,5-dihydrofuran-3-carboxylate |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
300.082015546 u |
| Formula |
C17H16O3S |
| InChI |
InChI=1S/C17H16O3S/c1-12-14(10-15(20-12)16-8-5-9-21-16)17(18)19-11-13-6-3-2-4-7-13/h2-9,15H,10-11H2,1H3/t15-/m1/s1 |
| InChIKey |
MQEMMGOJOQQHHY-OAHLLOKOSA-N |
| Instrument Name |
Agilent 7890A-5975C |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201804614 |
| Optical Rotation |
[a]D20 = -158.4 (c = 0.8, CH2Cl2) |
| Quality |
125 |
| SMILES |
[C@@]1(OC(=C(C1)C(=O)OCC1=CC=CC=C1)C)(C=1SC=CC1)[H] |
| SPLASH |
splash10-0006-9000000000-7332c235cf545653f57e |
| Sample Comments |
er = 15.85 |
| Source of Spectrum |
ACI-57-SM40-2r (DOI: 10.1002/anie.201804614) |
| Wiley ID |
1893051 |
