| SpectraBase Spectrum ID |
J4hSHPM4J2b |
| Name |
(S)-(+)-2-[2-(4-Bromophenyl)ethyl]-1,3-propanediol Acetate Methanesulfonate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H19BrO5S |
| InChI |
InChI=1S/C14H19BrO5S/c1-11(16)19-9-13(10-20-21(2,17)18)4-3-12-5-7-14(15)8-6-12/h5-8,13H,3-4,9-10H2,1-2H3/t13-/m0/s1 |
| InChIKey |
QVJCULVIYADKHG-ZDUSSCGKSA-N |
| Molecular Weight |
379.265 g/mol |
| SMILES |
C(OS(=O)(=O)C)[C@](COC(=O)C)(CCc1ccc(cc1)Br)[H] |
| SPLASH |
splash10-003r-0009000000-b6d9fe4e701fad4b804c |
| Source of Spectrum |
J-59-7043-9 |
| Synonyms |
(2S)-4-(4-bromophenyl)-2-{[(methylsulfonyl)oxy]methyl}butyl acetate
[(2S)-4-(4-bromophenyl)-2-(methylsulfonyloxymethyl)butyl] acetate
[(2S)-4-(4-bromophenyl)-2-(methylsulfonyloxymethyl)butyl] ethanoate |
| Wiley ID |
1358473 |
![(S)-(+)-2-[2-(4-Bromophenyl)ethyl]-1,3-propanediol Acetate Methanesulfonate](/api/spectrum/J4hSHPM4J2b/structure.png?h=300&w=458 "(S)-(+)-2-[2-(4-Bromophenyl)ethyl]-1,3-propanediol Acetate Methanesulfonate")
