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1-(benzo[d][1,3]dioxol-4-yl)butan-1-one
SpectraBase Compound ID Hz4TuGKHhHL
InChI InChI=1S/C11H12O3/c1-2-4-9(12)8-5-3-6-10-11(8)14-7-13-10/h3,5-6H,2,4,7H2,1H3
InChIKey XPQDNFHKHQKXQN-UHFFFAOYSA-N
Mol Weight 192.21 g/mol
Molecular Formula C11H12O3
Exact Mass 192.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eb7gzrvlo3u
Name 1-(benzo[d][1,3]dioxol-4-yl)butan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O3
InChI InChI=1S/C11H12O3/c1-2-4-9(12)8-5-3-6-10-11(8)14-7-13-10/h3,5-6H,2,4,7H2,1H3
InChIKey XPQDNFHKHQKXQN-UHFFFAOYSA-N
Molecular Weight 192.214 g/mol
SMILES c12c(cccc2C(CCC)=O)OCO1
SPLASH splash10-0002-2900000000-2dc71bfa3262b9705fac
Source of Spectrum Professor Randall Clark, Department: Drug Discovery and Development, Auburn University, Harrison School of Pharmacy, 3306 Walker Building, Auburn, AL 36849
Wiley ID 1815901