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1,4-Bis(trifluoroacetyl)-3-methyl-6-(2-methylpropyl)-2,5-diketopiperazine
SpectraBase Compound ID GX2q5X0eUWc
InChI InChI=1S/C12H12F6N2O4/c1-4(2)6-8(22)19(9(23)11(13,14)15)5(3)7(21)20(6)10(24)12(16,17)18/h4-6H,1-3H3/t5-,6-/m0/s1
InChIKey ZVJUGFHLZHGLMK-WDSKDSINSA-N
Mol Weight 362.23 g/mol
Molecular Formula C12H12F6N2O4
Exact Mass 362.070126 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IXYXDcMyMFL
Name 1,4-Bis(trifluoroacetyl)-3-methyl-6-(2-methylpropyl)-2,5-diketopiperazine
CAS Registry Number 71598-90-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12F6N2O4
InChI InChI=1S/C12H12F6N2O4/c1-4(2)6-8(22)19(9(23)11(13,14)15)5(3)7(21)20(6)10(24)12(16,17)18/h4-6H,1-3H3/t5-,6-/m0/s1
InChIKey ZVJUGFHLZHGLMK-WDSKDSINSA-N
Molecular Weight 362.228 g/mol
SMILES C1(N([C@](C(N([C@]1(C)[H])C(C(F)(F)F)=O)=O)(C(C)C)[H])C(C(F)(F)F)=O)=O
SPLASH splash10-0006-8902000000-555359ef662fea00df92
Source of Spectrum I-57-2040-0
Synonyms 3-Isopropyl-6-methyl-1,4-bis(trifluoroacetyl)-2,5-piperazinedione
Wiley ID 1349223