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3-Phenylhexahydro-1H-oxazolo[3,4-a]pyridine

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

3-Phenylhexahydro-1H-oxazolo[3,4-a]pyridine
SpectraBase Compound ID 9OpU1taSPgJ
InChI InChI=1S/C13H17NO/c1-2-6-11(7-3-1)13-14-9-5-4-8-12(14)10-15-13/h1-3,6-7,12-13H,4-5,8-10H2
InChIKey ROJRUMMOALVSBM-UHFFFAOYSA-N
Mol Weight 203.28 g/mol
Molecular Formula C13H17NO
Exact Mass 203.131014 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Kx0njFkPb64
Name 3-Phenylhexahydro-1H-oxazolo[3,4-A]pyridine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 203.131014170 u
Formula C13H17NO
InChI InChI=1S/C13H17NO/c1-2-6-11(7-3-1)13-14-9-5-4-8-12(14)10-15-13/h1-3,6-7,12-13H,4-5,8-10H2
InChIKey ROJRUMMOALVSBM-UHFFFAOYSA-N
Molecular Weight 203.285 g/mol
SMILES C1(N2C(CO1)CCCC2)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.906297