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3-morpholin-4-yl-4-oxidanyl-cyclobut-2-en-1-one
SpectraBase Compound ID 3bGdjxHZpG1
InChI InChI=1S/C8H11NO3/c10-7-5-6(8(7)11)9-1-3-12-4-2-9/h5,8,11H,1-4H2
InChIKey FNTWELCYMODFDR-UHFFFAOYSA-N
Mol Weight 169.18 g/mol
Molecular Formula C8H11NO3
Exact Mass 169.073893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2XHVDPpmGwr
Name 3-morpholin-4-yl-4-oxidanyl-cyclobut-2-en-1-one
Alternate Name(s) 4-hydroxy-3-(4-morpholinyl)-1-cyclobut-2-enone 4-hydroxy-3-morpholin-4-ylcyclobut-2-en-1-one 4-hydroxy-3-morpholino-cyclobut-2-en-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C8H11NO3
InChI InChI=1S/C8H11NO3/c10-7-5-6(8(7)11)9-1-3-12-4-2-9/h5,8,11H,1-4H2
InChIKey FNTWELCYMODFDR-UHFFFAOYSA-N
Molecular Weight 169.180 g/mol
SMILES OC1C(C=C1N1CCOCC1)=O
SPLASH splash10-0aor-9600000000-d34a740592ee8b91fc2b
Source of Spectrum K-2001-70-15
Wiley ID 1578407