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Acetic acid, 2-propenyl ester
SpectraBase Compound ID 6lyAdaQhXWq
InChI InChI=1S/C5H8O2/c1-3-4-7-5(2)6/h3H,1,4H2,2H3
InChIKey FWZUNOYOVVKUNF-UHFFFAOYSA-N
Mol Weight 100.12 g/mol
Molecular Formula C5H8O2
Exact Mass 100.052429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DEpK5E8ZlFR
Name Acetic acid, 2-propenyl ester
CAS Registry Number 591-87-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H8O2
InChI InChI=1S/C5H8O2/c1-3-4-7-5(2)6/h3H,1,4H2,2H3
InChIKey FWZUNOYOVVKUNF-UHFFFAOYSA-N
Molecular Weight 100.117 g/mol
SMILES C=CCOC(C)=O
SPLASH splash10-0006-9000000000-833f7318f5316668db78
Source of Spectrum IC-46-0-0
Synonyms 2-Propenyl acetate 2-Propenyl ester of acetic acid 2-Propenyl ethanoate 2-Propenyl methanoate 3-Acetoxy-1-propene 3-Acetoxypropene Acetic acid allyl ester Acetic acid prop-2-enyl ester Alloac CH2=C(CH3)OC(=O)CH3 Prop-2-enyl acetate Prop-2-enyl ethanoate Allyl acetate AI3-22625 BRN 1742050 EINECS 209-734-8 HSDB 2697 NSC 7612 UN2333
Wiley ID 1119368