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mass spectrometry (MS)

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

Dataset description:

dataset for mass spectrometry (MS)\n\n

Source: mass spectrometry (MS)

Chemical Info

molecular Image

InChI	InChI=1S/C27H20F15NO/c1-2-3-4-8-13-18-14-9-10-15-19(18)43(16-17-11-6-5-7-12-17)20(44)21(28,29)22(30,31)23(32,33)24(34,35)25(36,37)26(38,39)27(40,41)42/h5-7,9-12,14-15H,2-4,16H2,1H3
SMILES	CCCCC#Cc1ccccc1N(C(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Cc1ccccc1
InChI Key	KSXCBKGDAXBVCF-UHFFFAOYSA-N
Molecular Formula	C27H20F15NO
Exact Mass	659.430 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	baa65e67-b583-44a8-8935-4dc06e50d42a
Package id	10-14272-ksxcbkgdaxbvcf-uhfffaoysa-n-chmo0000470
Resource type	HTML
State	active