This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP009213 contains the MS mass spectrum of P-CRESOL with the InChIkey IWDCLRJOBJJRNH-UHFFFAOYSA-N.
This is the CSV file that can be used as a local database in MetFrag (https://msbi.ipb-halle.de/MetFrag/), for those who wish to integrate this into the command line version. Note that this file is
This MassBank record with Accession MSBNK-RIKEN-PR303983 contains the MS2 mass spectrum of (-)-Podophyllotoxin with the InChIkey YJGVMLPVUAXIQN-XVVDYKMHSA-N.
This MassBank record with Accession MSBNK-Antwerp_Univ-AN112903 contains the MS2 mass spectrum of Di(2-ethylhexyl) phthalate with the InChIkey BJQHLKABXJIVAM-UHFFFAOYSA-N.
