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20-{(Bis-(2-hydroxy-ethyl)-amino)-methyl}-2,5,8,11,14,17-hexaoxa-tricyclo(13.8.0.0(16,21))tricosa-1(23),15,19,21-tetraen-18-one
SpectraBase Compound ID D28MGP9DYiW
InChI InChI=1S/C22H31NO9/c24-5-3-23(4-6-25)16-17-15-20(26)32-21-18(17)1-2-19-22(21)31-14-12-29-10-8-27-7-9-28-11-13-30-19/h1-2,15,24-25H,3-14,16H2
InChIKey VIPYRIADICTPFT-UHFFFAOYSA-N
Mol Weight 453.49 g/mol
Molecular Formula C22H31NO9
Exact Mass 453.199882 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HuaohuGi3jo
Name 20-{(Bis-(2-hydroxy-ethyl)-amino)-methyl}-2,5,8,11,14,17-hexaoxa-tricyclo(13.8.0.0(16,21))tricosa-1(23),15,19,21-tetraen-18-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H31NO9
InChI InChI=1S/C22H31NO9/c24-5-3-23(4-6-25)16-17-15-20(26)32-21-18(17)1-2-19-22(21)31-14-12-29-10-8-27-7-9-28-11-13-30-19/h1-2,15,24-25H,3-14,16H2
InChIKey VIPYRIADICTPFT-UHFFFAOYSA-N
Molecular Weight 453.488 g/mol
SMILES OCCN(CCO)CC=1c2c(c3c(OCCOCCOCCOCCO3)cc2)OC(C1)=O
SPLASH splash10-0pbc-0009000000-59048eb40a2e0d11724f
Source of Spectrum Y-47-1131-11
Wiley ID 1667324