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3-Methyl-5-(5,5-dimethyl-1-oxide-4,5-dihydro-3H-pyrrol-2-yl)penta-2,4-dienoic acid ethyl ester
SpectraBase Compound ID 3v9oe8aOlb
InChI InChI=1S/C14H21NO3/c1-5-18-13(16)10-11(2)6-7-12-8-9-14(3,4)15(12)17/h6-7,10H,5,8-9H2,1-4H3/b7-6+,11-10+
InChIKey YHRJFGSVWHPZRD-MVQNEBOGSA-N
Mol Weight 251.33 g/mol
Molecular Formula C14H21NO3
Exact Mass 251.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9dvitSaHTek
Name 3-Methyl-5-(5,5-dimethyl-1-oxide-4,5-dihydro-3H-pyrrol-2-yl)penta-2,4-dienoic acid ethyl ester
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Formula C14H21NO3
InChI InChI=1S/C14H21NO3/c1-5-18-13(16)10-11(2)6-7-12-8-9-14(3,4)15(12)17/h6-7,10H,5,8-9H2,1-4H3/b7-6+,11-10+
InChIKey YHRJFGSVWHPZRD-MVQNEBOGSA-N
Molecular Weight 251.326 g/mol
SMILES C1(=[N+](C(CC1)(C)C)[O-])\C=C\C(=C\C(=O)OCC)C
SPLASH splash10-05fu-3090000000-24e95cbf4bc283d3d325
Source of Spectrum C5-2003-1369-6
Synonyms (2E,4E)-5-(5,5-dimethyl-1-oxido-3,4-dihydropyrrol-1-ium-2-yl)-3-methylpenta-2,4-dienoic acid ethyl ester Ethyl (2E,4E)-5-(5,5-dimethyl-1-oxido-3,4-dihydropyrrol-1-ium-2-yl)-3-methylpenta-2,4-dienoate Ethyl (2E,4E)-5-(5,5-dimethyl-1-oxido-3,4-dihydropyrrol-1-ium-2-yl)-3-methyl-penta-2,4-dienoate Ethyl (2E,4E)-5-(5,5-dimethyl-1-oxidanidyl-3,4-dihydropyrrol-1-ium-2-yl)-3-methyl-penta-2,4-dienoate
Wiley ID 1615597