| SpectraBase Spectrum ID |
a424c6KlVL |
| Name |
3-Octyl-1,2,4-trimethoxy-5-nitrobenzene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H27NO5 |
| InChI |
InChI=1S/C17H27NO5/c1-5-6-7-8-9-10-11-13-16(22-3)14(18(19)20)12-15(21-2)17(13)23-4/h12H,5-11H2,1-4H3 |
| InChIKey |
CJPKLXHZLWVOKJ-UHFFFAOYSA-N |
| Molecular Weight |
325.405 g/mol |
| SMILES |
c1(N(=O)=O)c(c(CCCCCCCC)c(c(c1)OC)OC)OC |
| SPLASH |
splash10-004i-0019000000-680fa74fb6edfbf0cd53 |
| Source of Spectrum |
H1-38-669-3 |
| Synonyms |
1,2,4-trimethoxy-5-nitro-3-octylbenzene |
| Wiley ID |
756145 |
