(2'S/2'R)-5-[2'-N-(tert-Butoxycarbonyl)pyrrolidinyl]-3,6-bis(trifluoromethyl)-1,2,4-triazone

SpectraBase Compound ID	FNV9cbl1G4r
InChI	InChI=1S/C14H16F6N4O2/c1-12(2,3)26-11(25)24-6-4-5-7(24)8-9(13(15,16)17)22-23-10(21-8)14(18,19)20/h7H,4-6H2,1-3H3/t7-/m1/s1
InChIKey	FMBXKPWXGXZADV-SSDOTTSWSA-N Google Search
Mol Weight	386.3 g/mol
Molecular Formula	C14H16F6N4O2
Exact Mass	386.117745 g/mol

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SpectraBase Spectrum ID	KBfZstF6228
Name	(2'S/2'R)-5-[2'-N-(tert-Butoxycarbonyl)pyrrolidinyl]-3,6-bis(trifluoromethyl)-1,2,4-triazone
Alternate Name(s)	(2'R)-5-[2'-N-(tert-Butoxycarbonyl)pyrrolidinyl]-3,6-bis(trifluoromethyl)-1,2,4-triazone
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C14H16F6N4O2
InChI	InChI=1S/C14H16F6N4O2/c1-12(2,3)26-11(25)24-6-4-5-7(24)8-9(13(15,16)17)22-23-10(21-8)14(18,19)20/h7H,4-6H2,1-3H3/t7-/m1/s1
InChIKey	FMBXKPWXGXZADV-SSDOTTSWSA-N
Molecular Weight	386.298 g/mol
SMILES	c1(c(nnc(n1)C(F)(F)F)C(F)(F)F)[C@@]1(N(C(OC(C)(C)C)=O)CCC1)[H]
SPLASH	splash10-03di-0009000000-2c8e5ca533936186efc1
Source of Spectrum	QC-10-579-16
Wiley ID	871098