| SpectraBase Spectrum ID |
AVU3ROmD9Lj |
| Name |
Methyl 2-[(3-iso-propoxy-4-nitrophenyl)thio]benzoate |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H17NO5S |
| InChI |
InChI=1S/C17H17NO5S/c1-11(2)23-15-10-12(8-9-14(15)18(20)21)24-16-7-5-4-6-13(16)17(19)22-3/h4-11H,1-3H3 |
| InChIKey |
PMKSYBNUKNALJG-UHFFFAOYSA-N |
| Molecular Weight |
347.385 g/mol |
| SMILES |
c1cc([N+](=O)[O-])c(OC(C)C)cc1Sc1c(cccc1)C(OC)=O |
| SPLASH |
splash10-0a4i-0129000000-790c47cce9727f00ae8b |
| Source of Spectrum |
ACI-53-SMS4-2 |
| Synonyms |
Methyl 2-((3-isopropoxy-4-nitrophenyl)thio)benzoate |
| Wiley ID |
1782215 |
