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5,5-Dimethyl-3-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethylamino]-2-(1-oxopentyl)-1-cyclohex-2-enone
SpectraBase Compound ID 9wrZzv6sriF
InChI InChI=1S/C25H31F3N2O3/c1-5-6-7-21(31)23-20(13-24(3,4)14-22(23)32)29-11-10-17-15(2)30-19-9-8-16(12-18(17)19)33-25(26,27)28/h8-9,12,29-30H,5-7,10-11,13-14H2,1-4H3
InChIKey VPDYGLZJNIGSFL-UHFFFAOYSA-N
Mol Weight 464.53 g/mol
Molecular Formula C25H31F3N2O3
Exact Mass 464.228677 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H0IDsbn9RF1
Name 5,5-Dimethyl-3-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethylamino]-2-(1-oxopentyl)-1-cyclohex-2-enone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H31F3N2O3
InChI InChI=1S/C25H31F3N2O3/c1-5-6-7-21(31)23-20(13-24(3,4)14-22(23)32)29-11-10-17-15(2)30-19-9-8-16(12-18(17)19)33-25(26,27)28/h8-9,12,29-30H,5-7,10-11,13-14H2,1-4H3
InChIKey VPDYGLZJNIGSFL-UHFFFAOYSA-N
Molecular Weight 464.529 g/mol
SMILES N(C1=C(C(CC(C)(C)C1)=O)C(=O)CCCC)CCc1c([nH]c2c1cc(cc2)OC(F)(F)F)C
SPLASH splash10-054o-9580000000-1dab86b45ddf0db8865b
Synonyms 5,5-Dimethyl-3-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethylamino]-2-pentanoyl-cyclohex-2-en-1-one 5,5-Dimethyl-3-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethylamino]-2-valeryl-cyclohex-2-en-1-one 5,5-Dimethyl-3-[2-[2-methyl-5-(trifluoromethyloxy)-1H-indol-3-yl]ethylamino]-2-pentanoyl-cyclohex-2-en-1-one
Wiley ID 1445230