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2-Butenedioic acid, 2-[(7-methoxy-2,2-dimethyl-2H-1-benzopyran-5-yl)-2-propenylamino]-, dimethyl ester
SpectraBase Compound ID 4vevf82YW5Z
InChI InChI=1S/C21H25NO6/c1-7-10-22(17(20(24)27-6)13-19(23)26-5)16-11-14(25-4)12-18-15(16)8-9-21(2,3)28-18/h7-9,11-13H,1,10H2,2-6H3/b17-13+
InChIKey GPCLCKNPMKWOSG-GHRIWEEISA-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 AUywEwqrzcW
Name 2-Butenedioic acid, 2-[(7-methoxy-2,2-dimethyl-2H-1-benzopyran-5-yl)-2-propenylamino]-, dimethyl ester
Alternate Name(s) Dimethyl (2E)-2-[allyl(7-methoxy-2,2-dimethyl-2H-chromen-5-yl)amino]-2-butenedioate Dimethyl ester of (allyl(7-methoxy-2,2-dimethyl-2H-chromen-5-yl)amino)maleic acid
CAS Registry Number 66385-10-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25NO6
InChI InChI=1S/C21H25NO6/c1-7-10-22(17(20(24)27-6)13-19(23)26-5)16-11-14(25-4)12-18-15(16)8-9-21(2,3)28-18/h7-9,11-13H,1,10H2,2-6H3/b17-13+
InChIKey GPCLCKNPMKWOSG-GHRIWEEISA-N
Molecular Weight 387.432 g/mol
SMILES c1(N(\C(=C\C(=O)OC)C(=O)OC)CC=C)c2c(OC(C=C2)(C)C)cc(c1)OC
SPLASH splash10-0229-0039000000-0fe6a33d53d5cf3f6353
Source of Spectrum K-111-446-0
Wiley ID 1363397