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3,4-difluoro Propyl U-47700
SpectraBase Compound ID DkW2eSdNecC
InChI InChI=1S/C18H26F2N2O/c1-4-11-22(17-8-6-5-7-16(17)21(2)3)18(23)13-9-10-14(19)15(20)12-13/h9-10,12,16-17H,4-8,11H2,1-3H3/t16-,17-/m1/s1
InChIKey RVTOLUMXMICZQI-IAGOWNOFSA-N
Mol Weight 324.42 g/mol
Molecular Formula C18H26F2N2O
Exact Mass 324.20132 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 1AmBEGnpJz3
Name 3,4-Difluoropropyl U-47700
Source of Sample Cayman Chemical Company
Catalog Number 29562
Cell Type Capillary tube
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26F2N2O
IUPAC Name trans-N-(2-(Dimethylamino)cyclohexyl)-3,4-difluoro-N-propylbenzamide
InChI InChI=1S/C18H26F2N2O/c1-4-11-22(17-8-6-5-7-16(17)21(2)3)18(23)13-9-10-14(19)15(20)12-13/h9-10,12,16-17H,4-8,11H2,1-3H3/t16-,17-/m1/s1
InChIKey RVTOLUMXMICZQI-IAGOWNOFSA-N
Molecular Weight 324.416 g/mol
Purity >=98%
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Source Nd:YAG
SMILES c1(F)c(ccc(C(N(CCC)[C@@]2(CCCC[C@]2(N(C)C)[H])[H])=O)c1)F
Scans Performed 2560
Source of Spectrum Forensic Spectral Research
Technique FT-Raman