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Ethyl (2E)-2-Chloro[1,3-dihydro-4-(trifluoromethyl)-2H-naphtho[2,3-b][1,4]diazepin-2-ylidene]acetate
SpectraBase Compound ID 1QzWYeJaE6A
InChI InChI=1S/C18H14ClF3N2O2/c1-2-26-17(25)16(19)14-9-15(18(20,21)22)24-13-8-11-6-4-3-5-10(11)7-12(13)23-14/h3-8,23H,2,9H2,1H3/b16-14+
InChIKey PIOWPFAIQNBKFM-JQIJEIRASA-N
Mol Weight 382.77 g/mol
Molecular Formula C18H14ClF3N2O2
Exact Mass 382.06959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID v4Ml9IUrI
Name Ethyl (2E)-2-Chloro[1,3-dihydro-4-(trifluoromethyl)-2H-naphtho[2,3-b][1,4]diazepin-2-ylidene]acetate
Alternate Name(s) Ethyl (E)-2-chloro-2-(4-(trifluoromethyl)-1,3-dihydro-2H-naphtho[2,3-b][1,4]diazepin-2-ylidene)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14ClF3N2O2
InChI InChI=1S/C18H14ClF3N2O2/c1-2-26-17(25)16(19)14-9-15(18(20,21)22)24-13-8-11-6-4-3-5-10(11)7-12(13)23-14/h3-8,23H,2,9H2,1H3/b16-14+
InChIKey PIOWPFAIQNBKFM-JQIJEIRASA-N
Literature Reference DOI 10.1002/hlca.201500264
Molecular Weight 382.770 g/mol
SMILES N1c2cc3c(cc2N=C(C\C1=C/(C(=O)OCC)Cl)C(F)(F)F)cccc3
SPLASH splash10-0ul9-0039000000-68b1c13c98ea25b55e38
Source of Spectrum H-99-371-5d
Wiley ID 1800096