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(10'E/Z,5S,3'S)-3-(11'-Iodo-3'-methoxymethoxyundec-10'-en-1'-yl)-5-methylfuran-2(5H)-one
SpectraBase Compound ID 1826R0ZXhjN
InChI InChI=1S/C18H29IO4/c1-15-13-16(18(20)23-15)10-11-17(22-14-21-2)9-7-5-3-4-6-8-12-19/h8,12-13,15,17H,3-7,9-11,14H2,1-2H3/b12-8+/t15-,17-/m0/s1
InChIKey AVCNPAGCQALQMI-BHEMDECJSA-N
Mol Weight 436.33 g/mol
Molecular Formula C18H29IO4
Exact Mass 436.111054 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LTq3jUfkgRS
Name (10'E/Z,5S,3'S)-3-(11'-Iodo-3'-methoxymethoxyundec-10'-en-1'-yl)-5-methylfuran-2(5H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H29IO4
InChI InChI=1S/C18H29IO4/c1-15-13-16(18(20)23-15)10-11-17(22-14-21-2)9-7-5-3-4-6-8-12-19/h8,12-13,15,17H,3-7,9-11,14H2,1-2H3/b12-8+/t15-,17-/m0/s1
InChIKey AVCNPAGCQALQMI-BHEMDECJSA-N
Molecular Weight 436.330 g/mol
SMILES C1(C(=C[C@@](O1)(C)[H])CC[C@@](OCOC)(CCCCCC\C=C\I)[H])=O
SPLASH splash10-0002-9614000000-eea02345809f667268c4
Source of Spectrum J-66-858-5
Synonyms (5S)-3-[(3S,10E)-11-iodo-3-(methoxymethoxy)-10-undecenyl]-5-methyl-2(5H)-furanone (2S)-4-[(E,3S)-11-iodanyl-3-(methoxymethoxy)undec-10-enyl]-2-methyl-2H-furan-5-one
Wiley ID 1534362