| SpectraBase Spectrum ID |
KOwuWrbN2 |
| Name |
Dimethyl 4-Acetyl-3-methyl-8-nitro-2-benzoxepine-1,1(3H)-dicarboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H17NO8 |
| InChI |
InChI=1S/C17H17NO8/c1-9(19)13-7-11-5-6-12(18(22)23)8-14(11)17(15(20)24-3,16(21)25-4)26-10(13)2/h5-8,10H,1-4H3 |
| InChIKey |
WVTFMPKDEIEELX-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1002/hlca.201200004 |
| Molecular Weight |
363.322 g/mol |
| SMILES |
C1(OC(c2cc(ccc2C=C1C(=O)C)[N+](=O)[O-])(C(=O)OC)C(OC)=O)C |
| SPLASH |
splash10-00di-0094000000-24762e5b43b2b90c8a15 |
| Source of Spectrum |
H-95-1420-15j_12 |
| Synonyms |
Dimethyl 4-acetyl-3-methyl-8-nitrobenzo[c]oxepine-1,1(3H)-dicarboxylate |
| Wiley ID |
1784397 |
