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2(3H)-Furanone, dihydro-4-[1-(phenylsulfonyl)-2-octenyl]-, [R*,S*-(E)]-
SpectraBase Compound ID AAvqzvhLtZr
InChI InChI=1S/C18H24O4S/c1-2-3-4-5-9-12-17(15-13-18(19)22-14-15)23(20,21)16-10-7-6-8-11-16/h6-12,15,17H,2-5,13-14H2,1H3/b12-9+/t15-,17+/m0/s1
InChIKey ATSLRSHEEXOGJF-FMUPAYBXSA-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 CLh7fT1j09N
Name 2(3H)-Furanone, dihydro-4-[1-(phenylsulfonyl)-2-octenyl]-, [R*,S*-(E)]-
CAS Registry Number 113460-93-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O4S
InChI InChI=1S/C18H24O4S/c1-2-3-4-5-9-12-17(15-13-18(19)22-14-15)23(20,21)16-10-7-6-8-11-16/h6-12,15,17H,2-5,13-14H2,1H3/b12-9+/t15-,17+/m0/s1
InChIKey ATSLRSHEEXOGJF-FMUPAYBXSA-N
Molecular Weight 336.446 g/mol
SMILES [C@@](S(=O)(=O)c1ccccc1)([C@]1(CC(=O)OC1)[H])(\C=C\CCCCC)[H]
SPLASH splash10-0005-0910000000-1b660388df9d57fc7a81
Source of Spectrum B-40-1246-38
Synonyms (2'S(*),2'E,3'R(*))-3-[1'-(phenylsulfonyl)oct-2'-3nyl]butan-4-olide (4S)-4-[(1R,2E)-1-(phenylsulfonyl)-2-octenyl]dihydro-2(3H)-furanone
Wiley ID 1332296