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2(3H)-Furanone, dihydro-4-[1-[2-(methylthio)ethenyl]hexyl]-, [R*,R*-(Z)]-
SpectraBase Compound ID 7X2Cty7r9g9
InChI InChI=1S/C13H22O2S/c1-3-4-5-6-11(7-8-16-2)12-9-13(14)15-10-12/h7-8,11-12H,3-6,9-10H2,1-2H3/b8-7-/t11-,12-/m0/s1
InChIKey ZGRHNGVBYFNUAX-XPOJSHTGSA-N
Mol Weight 242.38 g/mol
Molecular Formula C13H22O2S
Exact Mass 242.134051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EbRmjx9JNWn
Name 2(3H)-Furanone, dihydro-4-[1-[2-(methylthio)ethenyl]hexyl]-, [R*,R*-(Z)]-
CAS Registry Number 113460-86-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O2S
InChI InChI=1S/C13H22O2S/c1-3-4-5-6-11(7-8-16-2)12-9-13(14)15-10-12/h7-8,11-12H,3-6,9-10H2,1-2H3/b8-7-/t11-,12-/m0/s1
InChIKey ZGRHNGVBYFNUAX-XPOJSHTGSA-N
Molecular Weight 242.377 g/mol
SMILES C1(OC[C@](C1)([C@](\C=C/SC)(CCCCC)[H])[H])=O
SPLASH splash10-052r-9500000000-a17b489b17fdcd69c28d
Source of Spectrum B-40-1243-28
Synonyms (1'S(*),2'Z,3R(*))-3-[3'-(methylthio)-1'-pentylprop-2'-enyl]butan-4-olide (4R)-4-[(1R,2Z)-3-(methylsulfanyl)-1-pentyl-2-propenyl]dihydro-2(3H)-furanone
Wiley ID 1244921