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Pyrrol4-[1-(4-methoxycarbonylmethoxy-phenyl)-1-methyl-ethyl]-phenoxymorpho-acetic acid, methyl ester
SpectraBase Compound ID 7FN5JRStVb4
InChI InChI=1S/C21H24O6/c1-21(2,15-5-9-17(10-6-15)26-13-19(22)24-3)16-7-11-18(12-8-16)27-14-20(23)25-4/h5-12H,13-14H2,1-4H3
InChIKey YDJDXUVAHLYULV-UHFFFAOYSA-N
Mol Weight 372.42 g/mol
Molecular Formula C21H24O6
Exact Mass 372.157288 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EagFA7olPZ5
Name Pyrrol4-[1-(4-methoxycarbonylmethoxy-phenyl)-1-methyl-ethyl]-phenoxymorpho-acetic acid, methyl ester
Comments Computed using SmartSpectra Model v1.42
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Exact Mass 372.157288487 u
Formula C21H24O6
InChI InChI=1S/C21H24O6/c1-21(2,15-5-9-17(10-6-15)26-13-19(22)24-3)16-7-11-18(12-8-16)27-14-20(23)25-4/h5-12H,13-14H2,1-4H3
InChIKey YDJDXUVAHLYULV-UHFFFAOYSA-N
Molecular Weight 372.417 g/mol
SMILES C(C1=CC=C(C=C1)OCC(=O)OC)(C1=CC=C(C=C1)OCC(=O)OC)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.973261