SpectraBase Compound ID | 84tRu4mXZDe |
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InChI | InChI=1S/C32H35N3O3/c1-2-37-29-18-16-25(17-19-29)30-24-28(33-38-30)14-9-15-31(36)34-20-22-35(23-21-34)32(26-10-5-3-6-11-26)27-12-7-4-8-13-27/h3-8,10-13,16-19,24,32H,2,9,14-15,20-23H2,1H3 |
InChIKey | HZQZFCCLSRDEFK-UHFFFAOYSA-N |
Mol Weight | 509.7 g/mol |
Molecular Formula | C32H35N3O3 |
Exact Mass | 509.267842 g/mol |
SpectraBase Spectrum ID | 6yQbKvKYOkR |
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Name | piperazine, 1-(diphenylmethyl)-4-[4-[5-(4-ethoxyphenyl)-3-isoxazolyl]-1-oxobutyl]- |
Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 509.267841996 u |
Formula | C32H35N3O3 |
InChI | InChI=1S/C32H35N3O3/c1-2-37-29-18-16-25(17-19-29)30-24-28(33-38-30)14-9-15-31(36)34-20-22-35(23-21-34)32(26-10-5-3-6-11-26)27-12-7-4-8-13-27/h3-8,10-13,16-19,24,32H,2,9,14-15,20-23H2,1H3 |
InChIKey | HZQZFCCLSRDEFK-UHFFFAOYSA-N |
Molecular Weight | 509.650 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2021_1942 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/12679549 |