| SpectraBase Spectrum ID |
2YsYaCW8lMJ |
| Name |
(+-)-(3S,4S)-3-((S)-1-(2-Chlorooxazol-4-yl)propan-2-yl)-4-hydroxyisochroman-1-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H14ClNO4 |
| InChI |
InChI=1S/C15H14ClNO4/c1-8(6-9-7-20-15(16)17-9)13-12(18)10-4-2-3-5-11(10)14(19)21-13/h2-5,7-8,12-13,18H,6H2,1H3/t8-,12-,13-/m0/s1 |
| InChIKey |
XVWCKCPHZSJLFB-HJIKLVIJSA-N |
| Molecular Weight |
307.733 g/mol |
| SMILES |
O[C@@]1([C@@](OC(c2ccccc12)=O)([C@](Cc1nc(Cl)oc1)(C)[H])[H])[H] |
| SPLASH |
splash10-0a4i-0009000000-dbff81d49e655d476aaa |
| Source of Spectrum |
F-67-9705-34b |
| Wiley ID |
1707362 |
