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5-NITRO-2-FUROIC ACID, 3-METHYL-3-(2-NITRO-alpha,alpha,alpha-TRIFLUORO-p-TOLUIDINO)BUTYL ESTER
SpectraBase Compound ID 1nLCFwxffEl
InChI InChI=1S/C17H16F3N3O7/c1-16(2,7-8-29-15(24)13-5-6-14(30-13)23(27)28)21-11-4-3-10(17(18,19)20)9-12(11)22(25)26/h3-6,9,21H,7-8H2,1-2H3
InChIKey WBTUKOWJKCEWRR-UHFFFAOYSA-N
Mol Weight 431.32 g/mol
Molecular Formula C17H16F3N3O7
Exact Mass 431.094034 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID KAuf5GO7joF
Name 5-NITRO-2-FUROIC ACID, 3-METHYL-3-(2-NITRO-alpha,alpha,alpha-TRIFLUORO-p-TOLUIDINO)BUTYL ESTER
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Catalog Number BTB 5503
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16F3N3O7
InChI InChI=1S/C17H16F3N3O7/c1-16(2,7-8-29-15(24)13-5-6-14(30-13)23(27)28)21-11-4-3-10(17(18,19)20)9-12(11)22(25)26/h3-6,9,21H,7-8H2,1-2H3
InChIKey WBTUKOWJKCEWRR-UHFFFAOYSA-N
Melting Point 159-161C
Molecular Weight 431.329010
Synonyms 2-FUROIC ACID, 5-NITRO-, 3-METHYL- 3-/2-NITRO-A,A,A-TRIFLUORO- P-TOLUIDINO/BUTYL ESTER
Technique KBr WAFER