SpectraBase Compound ID | AfSCl5J2DlL |
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InChI | InChI=1S/C22H28N2O3.ClHO4/c1-3-22(14-18(25)21(26)27-4-2)11-7-12-24-13-10-16-15-8-5-6-9-17(15)23-19(16)20(22)24;2-1(3,4)5/h5-6,8-9,18,25H,3-4,7,10-14H2,1-2H3;(H,2,3,4,5)/t18?,22-;/m1./s1 |
InChIKey | UNLIPWFSZYXYGK-HDNPKDEKSA-N |
Mol Weight | 468.93 g/mol |
Molecular Formula | C22H29ClN2O7 |
Exact Mass | 468.166329 g/mol |
SpectraBase Spectrum ID | ISlMtlJ1k3m |
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Name | 1-(2-carboxy-2-hydroxyethyl)-1-ethyl-1,2,3,4,6,7-hexahydro-12H-indolo[2,3-a]quinolizine-5-ium perchlorate, ethyl ester |
Conditions | Neutral |
Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C22H29ClN2O7 |
InChI | InChI=1S/C22H28N2O3.ClHO4/c1-3-22(14-18(25)21(26)27-4-2)11-7-12-24-13-10-16-15-8-5-6-9-17(15)23-19(16)20(22)24;2-1(3,4)5/h5-6,8-9,18,25H,3-4,7,10-14H2,1-2H3;(H,2,3,4,5)/t18?,22-;/m1./s1 |
InChIKey | UNLIPWFSZYXYGK-HDNPKDEKSA-N |
Sadtler IR Number | 61549 |
Sadtler UV Number | 34160N |
Solvent | Methanol |