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Ethyl 3-{2-[(tert-Butoxycarbonyl)amino]-6-methoxyphenyl}-4,4,4-trifluorobut-2-enoate
SpectraBase Compound ID Bkyp43CXoOp
InChI InChI=1S/C18H22F3NO5/c1-6-26-14(23)10-11(18(19,20)21)15-12(8-7-9-13(15)25-5)22-16(24)27-17(2,3)4/h7-10H,6H2,1-5H3,(H,22,24)/b11-10-
InChIKey CAGAEASCKJBCIG-KHPPLWFESA-N
Mol Weight 389.37 g/mol
Molecular Formula C18H22F3NO5
Exact Mass 389.145007 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HxjWTRe7Bp6
Name Ethyl 3-{2-[(tert-Butoxycarbonyl)amino]-6-methoxyphenyl}-4,4,4-trifluorobut-2-enoate
Alternate Name(s) Ethyl (2Z)-3-{2-[(tert-butoxycarbonyl)amino]-6-methoxyphenyl}-4,4,4-trifluoro-2-butenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22F3NO5
InChI InChI=1S/C18H22F3NO5/c1-6-26-14(23)10-11(18(19,20)21)15-12(8-7-9-13(15)25-5)22-16(24)27-17(2,3)4/h7-10H,6H2,1-5H3,(H,22,24)/b11-10-
InChIKey CAGAEASCKJBCIG-KHPPLWFESA-N
Molecular Weight 389.371 g/mol
SMILES N(C(OC(C)(C)C)=O)c1c(\C(C(F)(F)F)=C\C(=O)OCC)c(OC)ccc1
SPLASH splash10-014i-0091000000-b8b7b52fb55c00a63d69
Source of Spectrum K1-0-3149-2
Wiley ID 1589133