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2-[(acetyloxy)methyl]-4-iodobutyl acetate
SpectraBase Compound ID 4Eww3uyTOHZ
InChI InChI=1S/C9H15IO4/c1-7(11)13-5-9(3-4-10)6-14-8(2)12/h9H,3-6H2,1-2H3
InChIKey BBRUXHDMYDKKTH-UHFFFAOYSA-N
Mol Weight 314.12 g/mol
Molecular Formula C9H15IO4
Exact Mass 314.001504 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EtQNEILtErk
Name 2-[(acetyloxy)methyl]-4-iodobutyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H15IO4
InChI InChI=1S/C9H15IO4/c1-7(11)13-5-9(3-4-10)6-14-8(2)12/h9H,3-6H2,1-2H3
InChIKey BBRUXHDMYDKKTH-UHFFFAOYSA-N
Molecular Weight 314.119 g/mol
SMILES C(=O)(OCC(COC(=O)C)CCI)C
SPLASH splash10-0006-9100000000-dbd6faff500b0650a2a1
Source of Spectrum SK-25-625-28
Synonyms Acetic acid [2-(acetyloxymethyl)-4-iodobutyl] ester [2-(acetyloxymethyl)-4-iodobutyl] acetate [2-(acetoxymethyl)-4-iodo-butyl] acetate [2-(acetyloxymethyl)-4-iodanyl-butyl] ethanoate
Wiley ID 866502