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L-1-Bromo-3-methyl-2-phthalimidyl-pentane

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

L-1-Bromo-3-methyl-2-phthalimidyl-pentane
SpectraBase Compound ID 4NmZww4bxdR
InChI InChI=1S/C14H16BrNO2/c1-3-9(2)12(8-15)16-13(17)10-6-4-5-7-11(10)14(16)18/h4-7,9,12H,3,8H2,1-2H3
InChIKey OFIKEOZCHJKBNZ-UHFFFAOYSA-N
Mol Weight 310.19 g/mol
Molecular Formula C14H16BrNO2
Exact Mass 309.036442 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2J7oLx7SNa2
Name L-1-Bromo-3-methyl-2-phthalimidyl-pentane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 309.036441757 u
Formula C14H16BrNO2
InChI InChI=1S/C14H16BrNO2/c1-3-9(2)12(8-15)16-13(17)10-6-4-5-7-11(10)14(16)18/h4-7,9,12H,3,8H2,1-2H3
InChIKey OFIKEOZCHJKBNZ-UHFFFAOYSA-N
Molecular Weight 310.191 g/mol
SMILES C(C(C(CC)C)N1C(=O)C=2C(C1=O)=CC=CC2)Br
Spectrum/Structure Validation Score (Vapor Phase IR) 0.955665