(DHQD)2PHAL•(saccharin)2 (2.14)
DOI: 10.14469/hpc/14459 Metadata
Created: 2024-07-24 11:42
Last modified: 2024-08-01 14:15
License: Creative Commons: Attribution 4.0
Funding: (none given)
Description
NMR, IR, HRMS, and X-ray data for (DHQD)2PHAL•(saccharin)2 (2.14)
Files
| Filename | Size | Type | Description |
|---|---|---|---|
| NMR Spectra.mnova | 783KB | chemical/x-mnova | NMR Spectrum |
| NMR Spectra.mnpub | 0 | chemical/x-mnpub | Mestrenova signature file for NMR Spectra.mnova |
| IR Spectrum.a2r | 125KB | application/octet-stream | IR Spectrum |
| Mass Spectrum +.pdf | 164KB | application/pdf | Mass Spectrum (+ive ion mode) |
| Mass Spectrum −.pdf | 129KB | application/pdf | Mass Spectrum (−ive ion mode) |
| CB2204.doc | 36KB | application/msword | Crystal Data and Structure Refinement |
| CB2204_x.cif | 29KB | chemical/x-cif | CIF File |
| CB2204-PL1.png | 552KB | image/png | X-Ray Structure |
Member of collection / collaboration
| DOI | Description |
|---|---|
| 10.14469/hpc/14444 | Chapter 2 |
Subject Keywords
| Keyword | Value |
|---|---|
| inchi | InChI=1S/C40H38N5O3.C6H2NO3S.C5H3O2S.C2H4.2C2H2.CNO.CH3O.CH2.2CH.N.6H/c1-7-31(25(2)16-21-46-6)37(36-23-30-15-20-45(36)24-26(30)3)47-39-27(4)28(5)40(43-42-39)48-38(35-22-29-13-18-44(35)19-14-29)33-12-17-41-34-11-9-8-10-32(33)34;1-2-3-5-4-11(9,10)7-6(5)8;1-3-4-5(2)8(6)7;3*1-2;2-1-3;1-2;;;;;;;;;;/h1,4-5,7,10-12,16-17,19,26,29-30,35-38,44-45H,3,13,15,18,20,22-24H2,6H3;2-3H;1,3-4H;1H,2H3;2*1-2H;;1H3;1H2;2*1H;;;;;;;/t26-,29+,30-,35+,36+,37-,38-;;;;;;;;;;;;;;;;;/m0................./s1 |
| inchikey | DKZBIUSSAFCNCT-OAEYFXLWSA-N |