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mass spectrometry (MS)

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

Dataset description:

dataset for mass spectrometry (MS)\n\n

Source: mass spectrometry (MS)

Chemical Info

molecular Image

InChI	InChI=1S/C30H18F15NO/c1-16-9-5-6-12-18(16)15-46-20-14-8-7-13-19(20)21(22(46)17-10-3-2-4-11-17)23(47)24(31,32)25(33,34)26(35,36)27(37,38)28(39,40)29(41,42)30(43,44)45/h2-14H,15H2,1H3
SMILES	O=C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)c1c(c2ccccc2)n(c2c1cccc2)Cc1ccccc1C
InChI Key	KTPIZOYTZMBWTA-UHFFFAOYSA-N
Molecular Formula	C30H18F15NO
Exact Mass	693.446 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	220c1a77-7f30-4bd2-9cef-f15c0b5551f3
Package id	10-14272-ktpizoytzmbwta-uhfffaoysa-n-chmo0000470
Resource type	HTML
State	active