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2(3H)-Furanone, dihydro-4-[1-[2-(phenylsulfonyl)ethenyl]hexyl]-, [R*,S*-(E)]-
SpectraBase Compound ID H6frAjb2JVM
InChI InChI=1S/C18H24O4S/c1-2-3-5-8-15(16-13-18(19)22-14-16)11-12-23(20,21)17-9-6-4-7-10-17/h4,6-7,9-12,15-16H,2-3,5,8,13-14H2,1H3/b12-11+/t15-,16+/m1/s1
InChIKey IZIIFUPPGWUHBY-OEPMCUGXSA-N
Mol Weight 336.45 g/mol
Molecular Formula C18H24O4S
Exact Mass 336.13953 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C8ljCL2oEss
Name 2(3H)-Furanone, dihydro-4-[1-[2-(phenylsulfonyl)ethenyl]hexyl]-, [R*,S*-(E)]-
Alternate Name(s) (1'S(*),2'E,3R(*))-3-[3'-(phenylsulfonyl)-1'-pentylprop-2'-enyl]butan-4-olide (4R)-4-[(1S,2E)-1-pentyl-3-(phenylsulfonyl)-2-propenyl]dihydro-2(3H)-furanone
CAS Registry Number 113460-94-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O4S
InChI InChI=1S/C18H24O4S/c1-2-3-5-8-15(16-13-18(19)22-14-16)11-12-23(20,21)17-9-6-4-7-10-17/h4,6-7,9-12,15-16H,2-3,5,8,13-14H2,1H3/b12-11+/t15-,16+/m1/s1
InChIKey IZIIFUPPGWUHBY-OEPMCUGXSA-N
Molecular Weight 336.446 g/mol
SMILES [C@](\C=C\S(=O)(=O)c1ccccc1)([C@]1(CC(=O)OC1)[H])(CCCCC)[H]
SPLASH splash10-004i-9400000000-afc127c4450bb29249b3
Source of Spectrum B-40-1245-39
Wiley ID 1332294