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4-[2'-(Hydroxymethyl)anilino]-3-penten-2-one
SpectraBase Compound ID 8YJOUAg4VAB
InChI InChI=1S/C12H15NO2/c1-9(7-10(2)15)13-12-6-4-3-5-11(12)8-14/h3-7,13-14H,8H2,1-2H3/b9-7+
InChIKey NPEDGDMOSLUMHJ-VQHVLOKHSA-N
Mol Weight 205.26 g/mol
Molecular Formula C12H15NO2
Exact Mass 205.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4YbfxBllFA
Name 4-[2'-(Hydroxymethyl)anilino]-3-penten-2-one
Alternate Name(s) (3E)-4-[2-(hydroxymethyl)anilino]-3-penten-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO2
InChI InChI=1S/C12H15NO2/c1-9(7-10(2)15)13-12-6-4-3-5-11(12)8-14/h3-7,13-14H,8H2,1-2H3/b9-7+
InChIKey NPEDGDMOSLUMHJ-VQHVLOKHSA-N
Molecular Weight 205.257 g/mol
SMILES N(\C(=C\C(=O)C)C)c1c(CO)cccc1
SPLASH splash10-0006-9500000000-3a61740236181511e77c
Source of Spectrum D8-327-335-24
Wiley ID 1515179