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(phenylmethyl) 4-[[2,2-dimethyl-4,6-bis(oxidanylidene)-1,3-dioxan-5-ylidene]methylamino]benzoate
SpectraBase Compound ID 1qPOjuBT2Lu
InChI InChI=1S/C21H19NO6/c1-21(2)27-19(24)17(20(25)28-21)12-22-16-10-8-15(9-11-16)18(23)26-13-14-6-4-3-5-7-14/h3-12,22H,13H2,1-2H3
InChIKey VPPLNPLEQNPMKL-UHFFFAOYSA-N
Mol Weight 381.38 g/mol
Molecular Formula C21H19NO6
Exact Mass 381.121237 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JBlbe2j7z4V
Name (phenylmethyl) 4-[[2,2-dimethyl-4,6-bis(oxidanylidene)-1,3-dioxan-5-ylidene]methylamino]benzoate
Alternate Name(s) 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]benzoic acid (phenylmethyl) ester 4-[(4,6-diketo-2,2-dimethyl-1,3-dioxan-5-ylidene)methylamino]benzoic acid benzyl ester
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Formula C21H19NO6
InChI InChI=1S/C21H19NO6/c1-21(2)27-19(24)17(20(25)28-21)12-22-16-10-8-15(9-11-16)18(23)26-13-14-6-4-3-5-7-14/h3-12,22H,13H2,1-2H3
InChIKey VPPLNPLEQNPMKL-UHFFFAOYSA-N
Molecular Weight 381.384 g/mol
SMILES N(C=C1C(OC(OC1=O)(C)C)=O)c1ccc(C(OCc2ccccc2)=O)cc1
SPLASH splash10-006x-6938000000-80767ced78f1c264b097
Source of Spectrum KC-57-1011-10
Wiley ID 1622756