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3-(7'-Hydroxyhept-1'-yl)-5-methyl-pyrrolizidine

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

3-(7'-Hydroxyhept-1'-yl)-5-methyl-pyrrolizidine
SpectraBase Compound ID GxvjThYEFsR
InChI InChI=1S/C15H29NO/c1-13-8-9-15-11-10-14(16(13)15)7-5-3-2-4-6-12-17/h13-15,17H,2-12H2,1H3
InChIKey MFZOXDBTUJLBGM-UHFFFAOYSA-N
Mol Weight 239.4 g/mol
Molecular Formula C15H29NO
Exact Mass 239.224915 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HOnjWUpjBxY
Name 3-(7'-Hydroxyhept-1'-yl)-5-methyl-pyrrolizidine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 239.224914557 u
Formula C15H29NO
InChI InChI=1S/C15H29NO/c1-13-8-9-15-11-10-14(16(13)15)7-5-3-2-4-6-12-17/h13-15,17H,2-12H2,1H3
InChIKey MFZOXDBTUJLBGM-UHFFFAOYSA-N
Molecular Weight 239.403 g/mol
SMILES C12N(C(CC2)C)C(CC1)CCCCCCCO
Spectrum/Structure Validation Score (Vapor Phase IR) 0.90033