| SpectraBase Spectrum ID |
EpnTq4TGg5U |
| Name |
6-(2-(4-Nitrophenylseleno)ethyl)-5,7-dimethylphthalide |
| Alternate Name(s) |
5,7-dimethyl-6-{2-[(4-nitrophenyl)selanyl]ethyl}-2-benzofuran-1(3H)-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H17NO4Se |
| InChI |
InChI=1S/C18H17NO4Se/c1-11-9-13-10-23-18(20)17(13)12(2)16(11)7-8-24-15-5-3-14(4-6-15)19(21)22/h3-6,9H,7-8,10H2,1-2H3 |
| InChIKey |
AVDLHPAPMDSREO-UHFFFAOYSA-N |
| Molecular Weight |
390.309 g/mol |
| SMILES |
c1(N(=O)=O)ccc([Se]CCc2c(c3C(OCc3cc2C)=O)C)cc1 |
| SPLASH |
splash10-000i-0900000000-a4c2a9aca499d9bf02d3 |
| Source of Spectrum |
I-59-2156-0 |
| Wiley ID |
1365288 |
