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3C-dfe N-Cyclopropylmethyl

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

3C-dfe N-Cyclopropylmethyl
SpectraBase Compound ID 795WfhICgs0
InChI InChI=1S/C17H25F2NO3/c1-11(20-9-12-4-5-12)6-13-7-14(21-2)17(15(8-13)22-3)23-10-16(18)19/h7-8,11-12,16,20H,4-6,9-10H2,1-3H3
InChIKey VQZLFFAWSZWLTR-UHFFFAOYSA-N
Mol Weight 329.39 g/mol
Molecular Formula C17H25F2NO3
Exact Mass 329.18025 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6OLKA4GwKLZ
Name 3C-dfe N-Cyclopropylmethyl
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 329.180249992 u
Formula C17H25F2NO3
InChI InChI=1S/C17H25F2NO3/c1-11(20-9-12-4-5-12)6-13-7-14(21-2)17(15(8-13)22-3)23-10-16(18)19/h7-8,11-12,16,20H,4-6,9-10H2,1-3H3
InChIKey VQZLFFAWSZWLTR-UHFFFAOYSA-N
Molecular Weight 329.388 g/mol
SMILES C1(=C(C=C(C=C1OC)CC(NCC1CC1)C)OC)OCC(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.870435