SpectraBase Spectrum ID |
KpYmWgHF78u |
Name |
(+)-(R)-3-Formyl-4-methylpentyl Methanesulfonate |
Appearance |
Colorless oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
208.076930165 u |
Formula |
C8H16O4S |
InChI |
InChI=1S/C8H16O4S/c1-7(2)8(6-9)4-5-12-13(3,10)11/h6-8H,4-5H2,1-3H3/t8-/m0/s1 |
InChIKey |
DCPNUNQMEJIQNI-QMMMGPOBSA-N |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/jo302438k |
Molecular Weight |
208.272 g/mol |
Optical Rotation |
[a]D20 = +8.0 (c = 1.0, CH2Cl2) |
Quality |
127 |
Reported Formula |
C8H16O4S |
SMILES |
[C@@](CCOS(C)(=O)=O)(C=O)(C(C)C)[H] |
SPLASH |
splash10-0002-9200000000-faf20cb3cf471a503b4d |
Source of Spectrum |
JOC-78-624-21b (DOI: 10.1021/jo302438k) |
Wiley ID |
1911685 |