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3C-E N-Cyclopropylmethyl

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

3C-E N-Cyclopropylmethyl
SpectraBase Compound ID I9eRew7RJzq
InChI InChI=1S/C17H27NO3/c1-5-21-17-15(19-3)9-14(10-16(17)20-4)8-12(2)18-11-13-6-7-13/h9-10,12-13,18H,5-8,11H2,1-4H3
InChIKey UWXXFIFLBQVUIJ-UHFFFAOYSA-N
Mol Weight 293.41 g/mol
Molecular Formula C17H27NO3
Exact Mass 293.199094 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CfKaI4kW0z2
Name 3C-E N-Cyclopropylmethyl
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 293.199093730 u
Formula C17H27NO3
InChI InChI=1S/C17H27NO3/c1-5-21-17-15(19-3)9-14(10-16(17)20-4)8-12(2)18-11-13-6-7-13/h9-10,12-13,18H,5-8,11H2,1-4H3
InChIKey UWXXFIFLBQVUIJ-UHFFFAOYSA-N
Molecular Weight 293.407 g/mol
SMILES C1(=C(C=C(C=C1OC)CC(NCC1CC1)C)OC)OCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.875792