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mass spectrometry (MS)

URL: https://www.chemotion-repository.net/inchikey/VWKVPNYVURHBJP-UHFFFAOYSA-N/CHMO0000470

Dataset description:

dataset for mass spectrometry (MS)\n\n

Source: mass spectrometry (MS)

Chemical Info

molecular Image

InChI	InChI=1S/C21H13F17N2O2/c1-8-12(40-11-5-3-2-4-10(11)39-8)13-41-7-9(42-13)6-14(22,23)15(24,25)16(26,27)17(28,29)18(30,31)19(32,33)20(34,35)21(36,37)38/h2-5,9,13H,6-7H2,1H3
SMILES	Cc1nc2ccccc2nc1C1OCC(O1)CC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI Key	VWKVPNYVURHBJP-UHFFFAOYSA-N
Molecular Formula	C21H13F17N2O2
Exact Mass	648.313 g/mol

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Additional Information

Field	Value
Data last updated	September 8, 2024
Metadata last updated	September 8, 2024
Created	September 8, 2024
Format	HTML
License	No License Provided
Id	8394199f-ed3a-4490-9f76-b0698131c60c
Package id	10-14272-vwkvpnyvurhbjp-uhfffaoysa-n-chmo0000470
Resource type	HTML
State	active