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(Z)-2-(2-Ethyl-2,7a-dimethyltetrahydropyrrolo[2,1-b]oxazol-3(2H)-ylidene)-1-phenylethan-1-one
SpectraBase Compound ID EqBuI4EVdG0
InChI InChI=1S/C18H23NO2/c1-4-17(2)16(19-12-8-11-18(19,3)21-17)13-15(20)14-9-6-5-7-10-14/h5-7,9-10,13H,4,8,11-12H2,1-3H3/b16-13-
InChIKey FKCOZOXUMGLIFN-SSZFMOIBSA-N
Mol Weight 285.39 g/mol
Molecular Formula C18H23NO2
Exact Mass 285.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9hvhZZ7grkH
Name (Z)-2-(2-Ethyl-2,7a-dimethyltetrahydropyrrolo[2,1-b]oxazol-3(2H)-ylidene)-1-phenylethan-1-one
Appearance Yellow oil
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Formula C18H23NO2
InChI InChI=1S/C18H23NO2/c1-4-17(2)16(19-12-8-11-18(19,3)21-17)13-15(20)14-9-6-5-7-10-14/h5-7,9-10,13H,4,8,11-12H2,1-3H3/b16-13-
InChIKey FKCOZOXUMGLIFN-SSZFMOIBSA-N
Instrument Name Shimadzu GC-MS-QP5050A
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202000582
Molecular Weight 285.387 g/mol
Reported Formula C18H23NO2
SMILES C(\C=C/1N2CCCC2(C)OC1(C)CC)(=O)c1ccccc1
SPLASH splash10-055f-5940000000-297bf74ca3d570cf856e
Sample Comments mixture of two isomers, dr = 1.5:1, dr = 1.5:1
Source of Spectrum U1-2020-SM37-9g
Wiley ID 1860822