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1-(2-chlorobenzyl)-7,7-dimethyl-4,4-bis(trifluoromethyl)-4,6,7,8-tetrahydro-2,5(1H,3H)-quinazolinedione
SpectraBase Compound ID FBgPqmItjpi
InChI InChI=1S/C19H17ClF6N2O2/c1-16(2)7-12-14(13(29)8-16)17(18(21,22)23,19(24,25)26)27-15(30)28(12)9-10-5-3-4-6-11(10)20/h3-6H,7-9H2,1-2H3,(H,27,30)
InChIKey HFRQMDMZFMZJKJ-UHFFFAOYSA-N
Mol Weight 454.8 g/mol
Molecular Formula C19H17ClF6N2O2
Exact Mass 454.088274 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H96xpnULpwF
Name 1-[(2-chlorophenyl)methyl]-7,7-dimethyl-4,4-bis(trifluoromethyl)-1,2,3,4,5,6,7,8-octahydroquinazoline-2,5-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H17ClF6N2O2
InChI InChI=1S/C19H17ClF6N2O2/c1-16(2)7-12-14(13(29)8-16)17(18(21,22)23,19(24,25)26)27-15(30)28(12)9-10-5-3-4-6-11(10)20/h3-6H,7-9H2,1-2H3,(H,27,30)
InChIKey HFRQMDMZFMZJKJ-UHFFFAOYSA-N
Molecular Weight 454.800 g/mol
SMILES N1C(N(C=2CC(CC(C2C1(C(F)(F)F)C(F)(F)F)=O)(C)C)Cc1ccccc1Cl)=O
SPLASH splash10-004i-4900000000-c4ba2e84543cdd8b495f
Source of Spectrum IY-2-5075-4
Synonyms 2,5(1H,3H)-Quinazolinedione, 1-[(2-chlorophenyl)methyl]-4,6,7,8-tetrahydro-7,7-dimethyl-4,4-bis(trifluoromethyl)- 1-(2-Chlorobenzyl)-7,7-dimethyl-4,4-bis(trifluoromethyl)-4,6,7,8-tetrahydroquinazoline-2,5(1H,3H)-dione 1-(2-Chlorobenzyl)-2-hydroxy-7,7-dimethyl-4,4-bis(trifluoromethyl)-4,6,7,8-tetrahydroquinazolin-5(1H)-one 1-[(2-chlorophenyl)methyl]-7,7-dimethyl-4,4-bis(trifluoromethyl)-6,8-dihydro-3H-quinazoline-2,5-dione
Wiley ID 1658737