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(3S)-1-[(1R)-1-methylhexyl]pyrrolidin-3-ol

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

(3S)-1-[(1R)-1-methylhexyl]pyrrolidin-3-ol
SpectraBase Compound ID A3jPavotbSr
InChI InChI=1S/C11H23NO/c1-3-4-5-6-10(2)12-8-7-11(13)9-12/h10-11,13H,3-9H2,1-2H3/t10-,11+/m1/s1
InChIKey SXXNROFIPMYFGN-MNOVXSKESA-N
Mol Weight 185.31 g/mol
Molecular Formula C11H23NO
Exact Mass 185.177964 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID AQCnQ1JSn7s
Name (3S)-1-[(1R)-1-Methylhexyl]pyrrolidin-3-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 185.177964364 u
Formula C11H23NO
InChI InChI=1S/C11H23NO/c1-3-4-5-6-10(2)12-8-7-11(13)9-12/h10-11,13H,3-9H2,1-2H3/t10-,11+/m1/s1
InChIKey SXXNROFIPMYFGN-MNOVXSKESA-N
Molecular Weight 185.311 g/mol
SMILES C1N(CC[C@@]1(O)[H])[C@@](CCCCC)(C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.974714