Phylloquinone
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML81942
Dataset description:
This MassBank record with Accession MSBNK-Washington_State_Univ-BML81942 contains the MS mass spectrum of Phylloquinone with the InChIkey MBWXNTAXLNYFJB-LKUDQCMESA-N.
Source: Phylloquinone
Chemical Info
| InChI | InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+ |
|---|---|
| SMILES | CC1=C(C(=O)C2=CC=CC=C2C1=O)C/C=C(\C)/CCCC(C)CCCC(C)CCCC(C)C |
| InChI Key | MBWXNTAXLNYFJB-LKUDQCMESA-N |
| Molecular Formula | C31H46O2 |
| Exact Mass | 450.350 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-ShareAlike 4.0 International (CC BY-SA 4.0) |
| Id | 510ea7b9-7de3-4d8a-961d-29142db651f5 |
| Package id | msbnk-washington_state_univ-bml81942 |
| Resource type | HTML |
| State | active |