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(1Z)-1-([(Z)-2-(Butylamino)butyl]imino)-7-chloro-10-hydroxy-3-[3-(trifluoromethyl)phenyl]-1,3,4,10-tetrahydro-9(2H)-acridinone

View entire compound with spectra: 1 MS (GC)

(1Z)-1-([(Z)-2-(Butylamino)butyl]imino)-7-chloro-10-hydroxy-3-[3-(trifluoromethyl)phenyl]-1,3,4,10-tetrahydro-9(2H)-acridinone
SpectraBase Compound ID 2tS4fICzR6w
InChI InChI=1S/C28H31ClF3N3O2/c1-3-5-11-33-21(4-2)16-34-23-13-18(17-7-6-8-19(12-17)28(30,31)32)14-25-26(23)27(36)22-15-20(29)9-10-24(22)35(25)37/h6-10,12,15,18,21,33,37H,3-5,11,13-14,16H2,1-2H3/b34-23-
InChIKey VDTAXQXKCJJTLG-XSVYLIDLSA-N
Mol Weight 534.02 g/mol
Molecular Formula C28H31ClF3N3O2
Exact Mass 533.205689 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HwpI9r8WxMM
Name (1Z)-1-([(Z)-2-(Butylamino)butyl]imino)-7-chloro-10-hydroxy-3-[3-(trifluoromethyl)phenyl]-1,3,4,10-tetrahydro-9(2H)-acridinone
Alternate Name(s) 1-[[2-[Butylamino]butyl]imino]-7-chloro-1,3,4,10-tetrahydro-10-hydroxy-3-[3-(trifluoromethyl)phenyl]-9(2H)-acridinone
CAS Registry Number 80092-46-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H31ClF3N3O2
InChI InChI=1S/C28H31ClF3N3O2/c1-3-5-11-33-21(4-2)16-34-23-13-18(17-7-6-8-19(12-17)28(30,31)32)14-25-26(23)27(36)22-15-20(29)9-10-24(22)35(25)37/h6-10,12,15,18,21,33,37H,3-5,11,13-14,16H2,1-2H3/b34-23-
InChIKey VDTAXQXKCJJTLG-XSVYLIDLSA-N
Molecular Weight 534.023 g/mol
SMILES N(C(C\N=C/1C=2C(c3cc(ccc3N(C2CC(C1)c1cccc(c1)C(F)(F)F)O)Cl)=O)CC)CCCC
SPLASH splash10-03di-4910000000-a89142b2d83d6c97ea77
Source of Spectrum NP-15-8871-0
Wiley ID 1112958