| SpectraBase Spectrum ID |
5IUrX4maIb8 |
| Name |
dimethyl 3,4,5,6,7,8-hexahydro-3-hydroxymethylene-azulene-1,2-dicarboxylate |
| Alternate Name(s) |
dimethyl (3E)-3-(hydroxymethylene)-3,4,5,6,7,8-hexahydro-1,2-azulenedicarboxylate |
| CAS Registry Number |
111410-57-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H18O5 |
| InChI |
InChI=1S/C15H18O5/c1-19-14(17)12-10-7-5-3-4-6-9(10)11(8-16)13(12)15(18)20-2/h8,16H,3-7H2,1-2H3/b11-8+ |
| InChIKey |
GWPQTVXMJIDYFR-DHZHZOJOSA-N |
| Molecular Weight |
278.304 g/mol |
| SMILES |
O\C=C\1C(=C(C=2CCCCCC12)C(=O)OC)C(=O)OC |
| SPLASH |
splash10-0002-0090000000-673a95f659c5318c3863 |
| Source of Spectrum |
K-121-495-2 |
| Wiley ID |
1281898 |
