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5-[(2',3'-Dihydro-2'-oxo-1H-indol-3'-yl)(phenyl)methyl]-2,2,dimethyl-1,3-dioxanium-4,6-dione triethylammonium salt
SpectraBase Compound ID 3cPdVHzRcs6
InChI InChI=1S/C21H18NO5.C6H15N/c1-21(2)26-19(24)17(20(25)27-21)15(12-8-4-3-5-9-12)16-13-10-6-7-11-14(13)22-18(16)23;1-4-7(5-2)6-3/h3-11,15-16H,1-2H3,(H,22,23);4-6H2,1-3H3/q-1;/p+1
InChIKey CBNNEDRWRFYUMQ-UHFFFAOYSA-O
Mol Weight 466.58 g/mol
Molecular Formula C27H34N2O5
Exact Mass 466.246772 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Cy19Wee6C
Name 5-[(2',3'-Dihydro-2'-oxo-1H-indol-3'-yl)(phenyl)methyl]-2,2,dimethyl-1,3-dioxanium-4,6-dione triethylammonium salt
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H34N2O5
InChI InChI=1S/C21H18NO5.C6H15N/c1-21(2)26-19(24)17(20(25)27-21)15(12-8-4-3-5-9-12)16-13-10-6-7-11-14(13)22-18(16)23;1-4-7(5-2)6-3/h3-11,15-16H,1-2H3,(H,22,23);4-6H2,1-3H3/q-1;/p+1
InChIKey CBNNEDRWRFYUMQ-UHFFFAOYSA-O
Molecular Weight 466.578 g/mol
SMILES [NH+](CC)(CC)CC.N1c2c(C(C1=O)C([C-]1C(OC(OC1=O)(C)C)=O)c1ccccc1)cccc2
SPLASH splash10-00di-0590000000-941dc53133173247205e
Source of Spectrum U1-2002-3486-11
Wiley ID 1523369