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6-Methyl-1-morpholinoheptane-1,2-dione
SpectraBase Compound ID Dfbbo68VkMV
InChI InChI=1S/C12H21NO3/c1-10(2)4-3-5-11(14)12(15)13-6-8-16-9-7-13/h10H,3-9H2,1-2H3
InChIKey PSHFTPFTXSOFOT-UHFFFAOYSA-N
Mol Weight 227.3 g/mol
Molecular Formula C12H21NO3
Exact Mass 227.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GVhgc3x6f4H
Name 6-Methyl-1-morpholinoheptane-1,2-dione
Appearance Colorless oil
Carrier Gas Argon
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 227.152143537 u
Formula C12H21NO3
InChI InChI=1S/C12H21NO3/c1-10(2)4-3-5-11(14)12(15)13-6-8-16-9-7-13/h10H,3-9H2,1-2H3
InChIKey PSHFTPFTXSOFOT-UHFFFAOYSA-N
Instrument Name AMD 402
Ionization Type EI
Literature Reference DOI 10.1002/anie.202200062
Molecular Weight 227.304 g/mol
Quality 149
Reported Formula C12H21NO3
SMILES C1COCCN1C(=O)C(CCCC(C)C)=O
SPLASH splash10-03ka-9400000000-4dea4f1b5315dca1959e
Source of Spectrum ACI-61-SM12-3c (DOI: 10.1002/anie.202200062)
Thin-Layer Chromatography 0.3 (pentane/EA, 5:1)
Wiley ID 1897584