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Benzyl 1,2-dimethyl-4-[2-(methoxycarbonyl)ethyl]-3-[(methoxycarbonyl)methyl]pyrrole-5-carboxylate
SpectraBase Compound ID 2wtsBcPkmC5
InChI InChI=1S/C21H25NO6/c1-14-17(12-19(24)27-4)16(10-11-18(23)26-3)20(22(14)2)21(25)28-13-15-8-6-5-7-9-15/h5-9H,10-13H2,1-4H3
InChIKey CWBRLFYJWVBLQB-UHFFFAOYSA-N
Mol Weight 387.43 g/mol
Molecular Formula C21H25NO6
Exact Mass 387.168188 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5QP9T6WIGdm
Name Benzyl 1,2-dimethyl-4-[2-(methoxycarbonyl)ethyl]-3-[(methoxycarbonyl)methyl]pyrrole-5-carboxylate
Alternate Name(s) benzyl 4-(2-methoxy-2-oxoethyl)-3-(3-methoxy-3-oxopropyl)-1,5-dimethyl-1H-pyrrole-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25NO6
InChI InChI=1S/C21H25NO6/c1-14-17(12-19(24)27-4)16(10-11-18(23)26-3)20(22(14)2)21(25)28-13-15-8-6-5-7-9-15/h5-9H,10-13H2,1-4H3
InChIKey CWBRLFYJWVBLQB-UHFFFAOYSA-N
Molecular Weight 387.432 g/mol
SMILES c1([n](c(c(c1CCC(=O)OC)CC(=O)OC)C)C)C(OCc1ccccc1)=O
SPLASH splash10-000f-9037000000-bbcf1161ed45d21c9183
Source of Spectrum F-48-4704-14
Wiley ID 1363403