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1-Propanone, 1-(1,3-benzodioxol-5-yl)-3-(dimethylamino)-
SpectraBase Compound ID KEnq6cWjtqe
InChI InChI=1S/C12H15NO3/c1-13(2)6-5-10(14)9-3-4-11-12(7-9)16-8-15-11/h3-4,7H,5-6,8H2,1-2H3
InChIKey PWBLOELLKGNDKI-UHFFFAOYSA-N
Mol Weight 221.26 g/mol
Molecular Formula C12H15NO3
Exact Mass 221.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7fXC9EoVmHF
Name 1-Propanone, 1-(1,3-benzodioxol-5-yl)-3-(dimethylamino)-
CAS Registry Number 30418-50-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO3
InChI InChI=1S/C12H15NO3/c1-13(2)6-5-10(14)9-3-4-11-12(7-9)16-8-15-11/h3-4,7H,5-6,8H2,1-2H3
InChIKey PWBLOELLKGNDKI-UHFFFAOYSA-N
Molecular Weight 221.256 g/mol
SMILES CN(CCC(=O)c1cc2c(OCO2)cc1)C
SPLASH splash10-052b-9500000000-dad656e092f799c19946
Source of Spectrum AB-230-242-5
Synonyms 1-(1,3-Benzodioxol-5-yl)-3-(dimethylamino)-1-propanone 1-(1,3-benzodioxol-5-yl)-3-(dimethylamino)propan-1-one 3-N,N-dimethylamino-1-(3,4-methylenedioxyphenyl)-1-propanone Propiophenone, 3-(dimethylamino)-3',4'-(methylenedioxy)- Safrole I BRN 1316015
Wiley ID 1221255