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Dimethyl 2-[2-amino-3-(methoxycarbonyl)-4H-chromen-4-yl]malonate
SpectraBase Compound ID 3R3uDF40BTS
InChI InChI=1S/C16H17NO7/c1-21-14(18)11-10(12(15(19)22-2)16(20)23-3)8-6-4-5-7-9(8)24-13(11)17/h4-7,10,12H,17H2,1-3H3
InChIKey MUYIVWDWSSBLOJ-UHFFFAOYSA-N
Mol Weight 335.31 g/mol
Molecular Formula C16H17NO7
Exact Mass 335.100502 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3oHrDkkBqAA
Name Dimethyl 2-[2-amino-3-(methoxycarbonyl)-4H-chromen-4-yl]malonate
Alternate Name(s) Dimethyl 2-(2-amino-3-(methoxycarbonyl)-4H-chromen-4-yl)malonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17NO7
InChI InChI=1S/C16H17NO7/c1-21-14(18)11-10(12(15(19)22-2)16(20)23-3)8-6-4-5-7-9(8)24-13(11)17/h4-7,10,12H,17H2,1-3H3
InChIKey MUYIVWDWSSBLOJ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200700493
Molecular Weight 335.312 g/mol
SMILES NC1=C(C(C(C(OC)=O)C(OC)=O)c2ccccc2O1)C(=O)OC
SPLASH splash10-0zmi-9620000000-ab369fed3ca885a06eb6
Source of Spectrum ASC-350-591/SM6-7k
Wiley ID 1766053