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[4-(3-Methyl-1,4-dioxo-1,4,4a,8a-tetrahydro-naphthalen-2-ylmethyl)-phenyl]-carbamic acid tert-butyl ester
SpectraBase Compound ID EIjV8S7Xs6d
InChI InChI=1S/C23H23NO4/c1-14-19(21(26)18-8-6-5-7-17(18)20(14)25)13-15-9-11-16(12-10-15)24-22(27)28-23(2,3)4/h5-12H,13H2,1-4H3,(H,24,27)
InChIKey HQMWQROQIBRWCL-UHFFFAOYSA-N
Mol Weight 377.44 g/mol
Molecular Formula C23H23NO4
Exact Mass 377.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IQ9OKeqxpKE
Name [4-(3-Methyl-1,4-dioxo-1,4,4a,8a-tetrahydro-naphthalen-2-ylmethyl)-phenyl]-carbamic acid tert-butyl ester
Appearance Yellow solid
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Formula C23H23NO4
InChI InChI=1S/C23H23NO4/c1-14-19(21(26)18-8-6-5-7-17(18)20(14)25)13-15-9-11-16(12-10-15)24-22(27)28-23(2,3)4/h5-12H,13H2,1-4H3,(H,24,27)
InChIKey HQMWQROQIBRWCL-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 377.440 g/mol
SMILES N(c1ccc(CC=2C(c3c(cccc3)C(C2C)=O)=O)cc1)C(=O)OC(C)(C)C
SPLASH splash10-0c00-0139000000-2deb6efef912049e6d77
Source of Spectrum US20110059972A1
Wiley ID 1861696