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1-(6-Chloro-1,3-benzodioxol-5-yl)-4,4-dimethylpentan-2-one
SpectraBase Compound ID Bf5MGnlWdny
InChI InChI=1S/C14H17ClO3/c1-14(2,3)7-10(16)4-9-5-12-13(6-11(9)15)18-8-17-12/h5-6H,4,7-8H2,1-3H3
InChIKey UTYROFWBUCTPJR-UHFFFAOYSA-N
Mol Weight 268.74 g/mol
Molecular Formula C14H17ClO3
Exact Mass 268.086622 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Beo5QF5PBR0
Name 1-(6-Chloro-1,3-benzodioxol-5-yl)-4,4-dimethylpentan-2-one
Alternate Name(s) 1-(6-Chlorobenzo[d][1,3]dioxol-5-yl)-4,4-dimethylpentan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17ClO3
InChI InChI=1S/C14H17ClO3/c1-14(2,3)7-10(16)4-9-5-12-13(6-11(9)15)18-8-17-12/h5-6H,4,7-8H2,1-3H3
InChIKey UTYROFWBUCTPJR-UHFFFAOYSA-N
Literature Reference DOI 10.1002/asia.200800161
Molecular Weight 268.740 g/mol
SMILES c1c(c(cc2c1OCO2)CC(=O)CC(C)(C)C)Cl
SPLASH splash10-00xs-9540000000-c6ed43a6d5663493e053
Source of Spectrum CAJ-3-1686-4l
Wiley ID 1775079