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(+)-(R)-3-Formyl-4-methylpentyl Methanesulfonate
SpectraBase Compound ID I4cZyYaejVu
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
Mol Weight 208.27 g/mol
Molecular Formula C8H16O4S
Exact Mass 208.07693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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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