DIMETHYL...
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP010255
Dataset description:
This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP010255 contains the MS mass spectrum of DIMETHYL (3R,5S,6R*)-3-PHENYL-2,3,4,5,6,7-HEXAHYDROINDEN-1(H)-ONE-5,6-DICARBOXYLATE...
Source: DIMETHYL (3R*,5S*,6R*)-3-PHENYL-2,3,4,5,6,7-HEXAHYDROINDEN-1(H)-ONE-5,6-DICARBOXYLATE
Chemical Info
| InChI | InChI=1S/C19H20O5/c1-23-18(21)15-8-13-12(11-6-4-3-5-7-11)10-17(20)14(13)9-16(15)19(22)24-2/h3-7,12,15-16H,8-10H2,1-2H3/t12-,15+,16-/m1/s1 |
|---|---|
| SMILES | COC(=O)C(C1)C(C(=O)OC)CC(C2c(c3)cccc3)=C1C(=O)C2 |
| InChI Key | ILKGAHQRSGVBBZ-UHOFOFEASA-N |
| Molecular Formula | C19H20O5 |
| Exact Mass | 328.131 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | January 11, 2024 |
| Metadata last updated | January 11, 2024 |
| Created | January 11, 2024 |
| Format | HTML |
| License | Attribution-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0) |
| Id | d7ad89a1-933f-4693-a816-aa39d1ae706f |
| Package id | msbnk-fac_eng_univ_tokyo-jp010255 |
| Resource type | HTML |
| State | active |