SpectraBase Spectrum ID |
IdaBgm1aIV0 |
Name |
2-(S)-(o-Bromophenoxy)butanoic Acid (R)-Pantolactone Ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H19BrO5 |
InChI |
InChI=1S/C16H19BrO5/c1-4-11(21-12-8-6-5-7-10(12)17)14(18)22-13-15(19)20-9-16(13,2)3/h5-8,11,13H,4,9H2,1-3H3/t11-,13+/m0/s1 |
InChIKey |
VSZDBCGLCVSODX-WCQYABFASA-N |
Molecular Weight |
371.227 g/mol |
SMILES |
[C@]1(OC([C@@](Oc2c(Br)cccc2)(CC)[H])=O)(C(OCC1(C)C)=O)[H] |
SPLASH |
splash10-01b9-9732000000-74b62d80f7bb82b7c76b |
Source of Spectrum |
J-59-4685-4 |
Wiley ID |
1354022 |