For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

3-N-Propyl-adamantol-1

View entire compound with spectra: 1 FTIR

3-N-Propyl-adamantol-1
SpectraBase Compound ID GeKO85o2T4q
InChI InChI=1S/C13H22O/c1-2-3-12-5-10-4-11(6-12)8-13(14,7-10)9-12/h10-11,14H,2-9H2,1H3/t10-,11+,12-,13-
InChIKey DASJOTIHKLXABK-WNGYAQOMSA-N
Mol Weight 194.32 g/mol
Molecular Formula C13H22O
Exact Mass 194.167065 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2oayzBf7oUy
Name 3-N-Propyl-adamantol-1
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 194.167065327 u
Formula C13H22O
InChI InChI=1S/C13H22O/c1-2-3-12-5-10-4-11(6-12)8-13(14,7-10)9-12/h10-11,14H,2-9H2,1H3/t10-,11+,12-,13-
InChIKey DASJOTIHKLXABK-WNGYAQOMSA-N
Molecular Weight 194.318 g/mol
SMILES [C@]12(O)C[C@]3(CCC)C[C@@](C[C@](C2)(C3)[H])(C1)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.902147