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4-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-yl)-butyric acid ethyl ester
SpectraBase Compound ID H2alBZxH3T0
InChI InChI=1S/C13H14N2O4/c1-2-19-10(16)6-4-8-15-12(17)9-5-3-7-14-11(9)13(15)18/h3,5,7H,2,4,6,8H2,1H3
InChIKey IWKSLSIIHISMOG-UHFFFAOYSA-N
Mol Weight 262.26 g/mol
Molecular Formula C13H14N2O4
Exact Mass 262.095357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JN38XTpPFiR
Name 4-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-yl)-butyric acid ethyl ester
Alternate Name(s) N-[3-(Ethoxycarbonyl)propyl]-2,3-pyridinedicarboximide 4-(5,7-dioxo-6-pyrrolo[3,4-b]pyridinyl)butanoic acid ethyl ester ethyl 4-(5,7-dioxopyrrolo[3,4-b]pyridin-6-yl)butanoate ethyl 4-[5,7-bis(oxidanylidene)pyrrolo[3,4-b]pyridin-6-yl]butanoate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2O4
InChI InChI=1S/C13H14N2O4/c1-2-19-10(16)6-4-8-15-12(17)9-5-3-7-14-11(9)13(15)18/h3,5,7H,2,4,6,8H2,1H3
InChIKey IWKSLSIIHISMOG-UHFFFAOYSA-N
Molecular Weight 262.265 g/mol
SMILES C1(N(C(c2ncccc12)=O)CCCC(=O)OCC)=O
SPLASH splash10-004i-0920000000-afc30e29267751ef8cfb
Source of Spectrum F4-43-575-3e
Wiley ID 1675425