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(4E)-7,8-dimethyl-4-(4-morpholinylmethylidene)-2,3-dihydro-1-benzoxepin-5-one
SpectraBase Compound ID 4RZwOENF9Ss
InChI InChI=1S/C17H21NO3/c1-12-9-15-16(10-13(12)2)21-6-3-14(17(15)19)11-18-4-7-20-8-5-18/h9-11H,3-8H2,1-2H3/b14-11+
InChIKey NLLXJKNEMCYWCP-SDNWHVSQSA-N
Mol Weight 287.36 g/mol
Molecular Formula C17H21NO3
Exact Mass 287.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8TXkkAOOdLL
Name (4E)-7,8-dimethyl-4-(4-morpholinylmethylidene)-2,3-dihydro-1-benzoxepin-5-one
Comments Less than 3 mono-isotopic peaks
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Formula C17H21NO3
InChI InChI=1S/C17H21NO3/c1-12-9-15-16(10-13(12)2)21-6-3-14(17(15)19)11-18-4-7-20-8-5-18/h9-11H,3-8H2,1-2H3/b14-11+
InChIKey NLLXJKNEMCYWCP-SDNWHVSQSA-N
Molecular Weight 287.359 g/mol
SMILES c12C(\C(=C\N3CCOCC3)CCOc1cc(c(c2)C)C)=O
SPLASH splash10-004i-0090000000-8af9c5496964f05bbd63
Source of Spectrum Y-30-1657-25
Synonyms (4E)-7,8-dimethyl-4-(morpholin-4-ylmethylidene)-2,3-dihydro-1-benzoxepin-5-one (4E)-7,8-dimethyl-4-(morpholinomethylene)-2,3-dihydro-1-benzoxepin-5-one
Wiley ID 761270