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2-(azetidin-1-yl)-1-(benzo[d][1,3]dioxol-5-yl)butan-1-one
SpectraBase Compound ID CbswFviTSuB
InChI InChI=1S/C14H17NO3/c1-2-11(15-6-3-7-15)14(16)10-4-5-12-13(8-10)18-9-17-12/h4-5,8,11H,2-3,6-7,9H2,1H3
InChIKey LLPGRFKDMXSKAD-UHFFFAOYSA-N
Mol Weight 247.29 g/mol
Molecular Formula C14H17NO3
Exact Mass 247.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ypOn4JMsHx
Name 2-(azetidin-1-yl)-1-(benzo[d][1,3]dioxol-5-yl)butan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NO3
InChI InChI=1S/C14H17NO3/c1-2-11(15-6-3-7-15)14(16)10-4-5-12-13(8-10)18-9-17-12/h4-5,8,11H,2-3,6-7,9H2,1H3
InChIKey LLPGRFKDMXSKAD-UHFFFAOYSA-N
Molecular Weight 247.294 g/mol
SMILES c12c(ccc(c2)C(C(N2CCC2)CC)=O)OCO1
SPLASH splash10-0002-9000000000-98d9515549c2e7127e5c
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 1815925