5-METHYL-2-HEXANONE
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP008598
Dataset description:
This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP008598 contains the MS mass spectrum of 5-METHYL-2-HEXANONE with the InChIkey FFWSICBKRCICMR-UHFFFAOYSA-N.
Source: 5-METHYL-2-HEXANONE; EI-B; MS
Chemical Info
| InChI | InChI=1S/C7H14O/c1-6(2)4-5-7(3)8/h6H,4-5H2,1-3H3 |
|---|---|
| SMILES | CC(C)CCC(C)=O |
| InChI Key | FFWSICBKRCICMR-UHFFFAOYSA-N |
| Exact Mass | 114.104 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 | db0d0c88-7bc0-4b71-9423-ab44a88e1941 |
| Package id | msbnk-fac_eng_univ_tokyo-jp008598 |
| Resource type | HTML |
| State | active |