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(Z)-3-amino-3-[7-(3,4-dimethoxyphenyl)-3,4-dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]-2-propenoic acid tert-butyl ester

View entire compound with spectra: 1 MS (GC)

(Z)-3-amino-3-[7-(3,4-dimethoxyphenyl)-3,4-dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]-2-propenoic acid tert-butyl ester
SpectraBase Compound ID AULLTiInXSD
InChI InChI=1S/C25H31NO6/c1-24(2,3)32-23(27)13-22(26)25(16-8-9-18(28-4)20(11-16)30-6)14-15-10-19(29-5)21(31-7)12-17(15)25/h8-13H,14,26H2,1-7H3/b22-13-
InChIKey SSXRNAIKKCOYPE-XKZIYDEJSA-N
Mol Weight 441.52 g/mol
Molecular Formula C25H31NO6
Exact Mass 441.215138 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G9TziRf9c2V
Name (Z)-3-amino-3-[7-(3,4-dimethoxyphenyl)-3,4-dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]-2-propenoic acid tert-butyl ester
Alternate Name(s) (Z)-3-amino-3-[7-(3,4-dimethoxyphenyl)-3,4-dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]acrylic acid tert-butyl ester tert-butyl (Z)-3-amino-3-[7-(3,4-dimethoxyphenyl)-3,4-dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]prop-2-enoate tert-butyl (Z)-3-azanyl-3-[7-(3,4-dimethoxyphenyl)-3,4-dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]prop-2-enoate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H31NO6
InChI InChI=1S/C25H31NO6/c1-24(2,3)32-23(27)13-22(26)25(16-8-9-18(28-4)20(11-16)30-6)14-15-10-19(29-5)21(31-7)12-17(15)25/h8-13H,14,26H2,1-7H3/b22-13-
InChIKey SSXRNAIKKCOYPE-XKZIYDEJSA-N
Molecular Weight 441.524 g/mol
SMILES N\C(C1(c2cc(OC)c(cc2C1)OC)c1cc(OC)c(cc1)OC)=C/C(OC(C)(C)C)=O
SPLASH splash10-000i-0009200000-148a3638f5c14cc87ffd
Source of Spectrum KC-1992-3115-13
Wiley ID 777349