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Benzoic acid, 2-methoxy-, N'-[2,5-dioxo-1-[3-(trifluoromethyl)phenyl]-3-pyrrolidinyl]hydrazide
SpectraBase Compound ID H2ld3dKf74r
InChI InChI=1S/C19H16F3N3O4/c1-29-15-8-3-2-7-13(15)17(27)24-23-14-10-16(26)25(18(14)28)12-6-4-5-11(9-12)19(20,21)22/h2-9,14,23H,10H2,1H3,(H,24,27)
InChIKey JJKVJCOZGYZCDV-UHFFFAOYSA-N
Mol Weight 407.35 g/mol
Molecular Formula C19H16F3N3O4
Exact Mass 407.10929 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID RYOtmkHD0k
Name Benzoic acid, 2-methoxy-, N'-[2,5-dioxo-1-[3-(trifluoromethyl)phenyl]-3-pyrrolidinyl]hydrazide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 407.109290492 u
Formula C19H16F3N3O4
InChI InChI=1S/C19H16F3N3O4/c1-29-15-8-3-2-7-13(15)17(27)24-23-14-10-16(26)25(18(14)28)12-6-4-5-11(9-12)19(20,21)22/h2-9,14,23H,10H2,1H3,(H,24,27)
InChIKey JJKVJCOZGYZCDV-UHFFFAOYSA-N
Molecular Weight 407.349 g/mol
SMILES C1(N(C(C(C1)NNC(C=1C(OC)=CC=CC1)=O)=O)C1=CC(C(F)(F)F)=CC=C1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.826794