For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-(benzo[d][1,3]dioxol-5-yl)-3-methylbutan-1-one
SpectraBase Compound ID DQkye4ZaOx0
InChI InChI=1S/C12H14O3/c1-8(2)5-10(13)9-3-4-11-12(6-9)15-7-14-11/h3-4,6,8H,5,7H2,1-2H3
InChIKey PYJUDLMZSCWVRX-UHFFFAOYSA-N
Mol Weight 206.24 g/mol
Molecular Formula C12H14O3
Exact Mass 206.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID B34yq3r8x9s
Name 1-(benzo[d][1,3]dioxol-5-yl)-3-methylbutan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O3
InChI InChI=1S/C12H14O3/c1-8(2)5-10(13)9-3-4-11-12(6-9)15-7-14-11/h3-4,6,8H,5,7H2,1-2H3
InChIKey PYJUDLMZSCWVRX-UHFFFAOYSA-N
Molecular Weight 206.241 g/mol
SMILES c12c(ccc(c2)C(CC(C)C)=O)OCO1
SPLASH splash10-0002-3910000000-32d20ef51062e0ed0949
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 1815906