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6-Bromo-7-fluoro-1,2,3,4-tetrahydroquinoline, tms

View entire compound with spectra: 1 FTIR

6-Bromo-7-fluoro-1,2,3,4-tetrahydroquinoline, tms
SpectraBase Compound ID 9nKY256X4q4
InChI InChI=1S/C11H11BrFNO/c1-7(15)14-4-2-3-8-5-9(12)10(13)6-11(8)14/h5-6H,2-4H2,1H3
InChIKey OCRNSBKXPJRVER-UHFFFAOYSA-N
Mol Weight 272.12 g/mol
Molecular Formula C11H11BrFNO
Exact Mass 271.000805 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 69dKDQ9uWGD
Name 6-Bromo-7-fluoro-1,2,3,4-tetrahydroquinoline, tms
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 271.000805140 u
Formula C11H11BrFNO
InChI InChI=1S/C11H11BrFNO/c1-7(15)14-4-2-3-8-5-9(12)10(13)6-11(8)14/h5-6H,2-4H2,1H3
InChIKey OCRNSBKXPJRVER-UHFFFAOYSA-N
Molecular Weight 272.117 g/mol
SMILES C1(F)=CC2=C(C=C1Br)CCCN2C(=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.818766