SpectraBase Compound ID | JNznXK76TYM |
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InChI | InChI=1S/C29H36N2O10/c1-34-28(32)22-17-23(29(33)35-2)19-24(18-22)31-6-5-25(30-31)21-3-4-26-27(20-21)41-16-14-39-12-10-37-8-7-36-9-11-38-13-15-40-26/h3-4,17-20H,5-16H2,1-2H3 |
InChIKey | BQWLSFSXTCPGNS-UHFFFAOYSA-N |
Mol Weight | 572.6 g/mol |
Molecular Formula | C29H36N2O10 |
Exact Mass | 572.236995 g/mol |
SpectraBase Spectrum ID | K0gb9peppiR |
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Name | Dimethyl 5-[3-(2,3,5,6,8,9,11,12,14,15-Decahydro-1,4,7,10,13,16-benzohexaoxacyclooctadecin-18-yl)-4,5-dihydro-1H-pyrazol-1-yl]isophthalate |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C29H36N2O10 |
InChI | InChI=1S/C29H36N2O10/c1-34-28(32)22-17-23(29(33)35-2)19-24(18-22)31-6-5-25(30-31)21-3-4-26-27(20-21)41-16-14-39-12-10-37-8-7-36-9-11-38-13-15-40-26/h3-4,17-20H,5-16H2,1-2H3 |
InChIKey | BQWLSFSXTCPGNS-UHFFFAOYSA-N |
Molecular Weight | 572.611 g/mol |
SMILES | c1(N2N=C(CC2)c2cc3OCCOCCOCCOCCOCCOc3cc2)cc(C(=O)OC)cc(c1)C(=O)OC |
SPLASH | splash10-00di-0004090000-93f5ed92ef47c72bf42a |
Source of Spectrum | F-55-5220-11 |
Wiley ID | 837848 |