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Ethyl 2-(4-Iodobutyl)-4-oxa-7-phenyl-2,3,3-trimethyl-6(Z)-heptenoate
SpectraBase Compound ID EFtzvzZseRc
InChI InChI=1S/C21H31IO3/c1-5-24-19(23)21(4,15-9-10-16-22)20(2,3)25-17-11-14-18-12-7-6-8-13-18/h6-8,11-14H,5,9-10,15-17H2,1-4H3/b14-11+
InChIKey OHGDTSSYRPGIKH-SDNWHVSQSA-N
Mol Weight 458.38 g/mol
Molecular Formula C21H31IO3
Exact Mass 458.13179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fh8JH3QaCA2
Name Ethyl 2-(4-Iodobutyl)-4-oxa-7-phenyl-2,3,3-trimethyl-6(Z)-heptenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H31IO3
InChI InChI=1S/C21H31IO3/c1-5-24-19(23)21(4,15-9-10-16-22)20(2,3)25-17-11-14-18-12-7-6-8-13-18/h6-8,11-14H,5,9-10,15-17H2,1-4H3/b14-11+
InChIKey OHGDTSSYRPGIKH-SDNWHVSQSA-N
Molecular Weight 458.380 g/mol
SMILES C(C(=O)OCC)(C(OC\C=C\c1ccccc1)(C)C)(CCCCI)C
SPLASH splash10-0pdl-9224400000-07dd6976f7be5b985a5b
Source of Spectrum J-62-2855-33
Synonyms Ethyl 6-iodo-2-methyl-2-(1-methyl-1-{[(2E)-3-phenyl-2-propenyl]oxy}ethyl)hexanoate
Wiley ID 1389785