| SpectraBase Spectrum ID |
3pg1V24BACi |
| Name |
5-((4-(4-chloro-3,5-bis(methoxymethoxy)phenyl)butyl)sulfonyl)-1-phenyl-1H-tetrazole |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H25ClN4O6S |
| InChI |
InChI=1S/C21H25ClN4O6S/c1-29-14-31-18-12-16(13-19(20(18)22)32-15-30-2)8-6-7-11-33(27,28)21-23-24-25-26(21)17-9-4-3-5-10-17/h3-5,9-10,12-13H,6-8,11,14-15H2,1-2H3 |
| InChIKey |
YMSKPYFKDMAGMW-UHFFFAOYSA-N |
| Instrument Name |
JEOL JMS-700 / JMS-DX303 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.jnatprod.7b00456 |
| Molecular Weight |
496.966 g/mol |
| Reported Formula |
C21H25N4O6(35)ClS |
| SMILES |
c1(Cl)c(cc(cc1OCOC)CCCCS(=O)(=O)c1nnn[n]1-c1ccccc1)OCOC |
| SPLASH |
splash10-0159-0910200000-953468f476be2bda946d |
| Source of Spectrum |
G4-80-SM6-13f |
| Wiley ID |
1867566 |
