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1,3-Butanedione, 1-[2-(diethylamino)-4-oxo-1-cyclobuten-1-yl]-
SpectraBase Compound ID 8zCh7XY9RbH
InChI InChI=1S/C12H17NO3/c1-4-13(5-2)9-7-11(16)12(9)10(15)6-8(3)14/h4-7H2,1-3H3
InChIKey ZRLNRGVSUTWSJT-UHFFFAOYSA-N
Mol Weight 223.27 g/mol
Molecular Formula C12H17NO3
Exact Mass 223.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LGdFNB9iDrv
Name 1,3-Butanedione, 1-[2-(diethylamino)-4-oxo-1-cyclobuten-1-yl]-
CAS Registry Number 79139-13-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17NO3
InChI InChI=1S/C12H17NO3/c1-4-13(5-2)9-7-11(16)12(9)10(15)6-8(3)14/h4-7H2,1-3H3
InChIKey ZRLNRGVSUTWSJT-UHFFFAOYSA-N
Molecular Weight 223.272 g/mol
SMILES C1(=C(N(CC)CC)CC1=O)C(CC(=O)C)=O
SPLASH splash10-0596-9400000000-df9be16729fc398c5a1d
Source of Spectrum K-114-1023-0
Synonyms 1-(2-Diethylamino-4-oxo-1-cyclobuten-1-yl)-1,3-butandione 1-[2-(diethylamino)-4-oxo-1-cyclobuten-1-yl]-1,3-butanedione
Wiley ID 1223975