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cis-2-Butyl-5-(4-hydroxybutyl)pyrrolidine

View entire compound with spectra: 1 FTIR

cis-2-Butyl-5-(4-hydroxybutyl)pyrrolidine
SpectraBase Compound ID GkdfpAlMawt
InChI InChI=1S/C12H25NO/c1-2-3-6-11-8-9-12(13-11)7-4-5-10-14/h11-14H,2-10H2,1H3/t11-,12+/m0/s1
InChIKey MMXKSGSSVOURGW-NWDGAFQWSA-N
Mol Weight 199.34 g/mol
Molecular Formula C12H25NO
Exact Mass 199.193614 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JDxQ63uwEms
Name cis-2-Butyl-5-(4-hydroxybutyl)pyrrolidine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 199.193614428 u
Formula C12H25NO
InChI InChI=1S/C12H25NO/c1-2-3-6-11-8-9-12(13-11)7-4-5-10-14/h11-14H,2-10H2,1H3/t11-,12+/m0/s1
InChIKey MMXKSGSSVOURGW-NWDGAFQWSA-N
Molecular Weight 199.338 g/mol
SMILES [C@]1(N[C@@](CCCC)(CC1)[H])(CCCCO)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.936145