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N-boc-2-[(E)-1-Hexenyl]pyrrolidine
SpectraBase Compound ID JrcXmwZHMJf
InChI InChI=1S/C15H27NO2/c1-5-6-7-8-10-13-11-9-12-16(13)14(17)18-15(2,3)4/h8,10,13H,5-7,9,11-12H2,1-4H3/b10-8+
InChIKey OFXWGDVBXJDMBA-CSKARUKUSA-N
Mol Weight 253.39 g/mol
Molecular Formula C15H27NO2
Exact Mass 253.204179 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JVhghpvS4lC
Name N-boc-2-[(E)-1-Hexenyl]pyrrolidine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 253.204179111 u
Formula C15H27NO2
InChI InChI=1S/C15H27NO2/c1-5-6-7-8-10-13-11-9-12-16(13)14(17)18-15(2,3)4/h8,10,13H,5-7,9,11-12H2,1-4H3/b10-8+
InChIKey OFXWGDVBXJDMBA-CSKARUKUSA-N
Molecular Weight 253.386 g/mol
SMILES C(N1C(\C=C\CCCC)CCC1)(OC(C)(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.972845