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3-Cyclohexene-1-carboxylic acid, 6-[[(6,7,8,9-tetrahydrobenzo[b]benzofuran-2-yl)amino]carbonyl]-
SpectraBase Compound ID Kpp1ld3TPtJ
InChI InChI=1S/C20H21NO4/c22-19(14-6-1-2-7-15(14)20(23)24)21-12-9-10-18-16(11-12)13-5-3-4-8-17(13)25-18/h1-2,9-11,14-15H,3-8H2,(H,21,22)(H,23,24)
InChIKey VLLLKBSANCJDDA-UHFFFAOYSA-N
Mol Weight 339.39 g/mol
Molecular Formula C20H21NO4
Exact Mass 339.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1UYinVfzIe
Name 3-Cyclohexene-1-carboxylic acid, 6-[[(6,7,8,9-tetrahydrobenzo[b]benzofuran-2-yl)amino]carbonyl]-
Alternate Name(s) 6-({8-oxatricyclo[7.4.0.0(2,7)]trideca-1(9),2(7),3,5-tetraen-4-yl}carbamoyl)cyclohex-3-ene-1-carboxylic acid 6-[oxo-(6,7,8,9-tetrahydrodibenzofuran-2-ylamino)methyl]-1-cyclohex-3-enecarboxylic acid
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Formula C20H21NO4
InChI InChI=1S/C20H21NO4/c22-19(14-6-1-2-7-15(14)20(23)24)21-12-9-10-18-16(11-12)13-5-3-4-8-17(13)25-18/h1-2,9-11,14-15H,3-8H2,(H,21,22)(H,23,24)
InChIKey VLLLKBSANCJDDA-UHFFFAOYSA-N
Molecular Weight 339.391 g/mol
SMILES N(C(C1C(C(=O)O)CC=CC1)=O)c1cc2c3c(oc2cc1)CCCC3
SPLASH splash10-0550-4900000000-cfe334089403415228ba
Source of Spectrum IY-2-4977-6
Wiley ID 1657759