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2-(Dicyclopropyl(hydroxy)methyl)-3-methoxybenzonitrile
SpectraBase Compound ID 3J2ka2Rerjk
InChI InChI=1S/C15H17NO2/c1-18-13-4-2-3-10(9-16)14(13)15(17,11-5-6-11)12-7-8-12/h2-4,11-12,17H,5-8H2,1H3
InChIKey DLANACLFRDBWBM-UHFFFAOYSA-N
Mol Weight 243.31 g/mol
Molecular Formula C15H17NO2
Exact Mass 243.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ln4DNwtj48a
Name 2-(Dicyclopropyl(hydroxy)methyl)-3-methoxybenzonitrile
Appearance Slightly yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17NO2
InChI InChI=1S/C15H17NO2/c1-18-13-4-2-3-10(9-16)14(13)15(17,11-5-6-11)12-7-8-12/h2-4,11-12,17H,5-8H2,1H3
InChIKey DLANACLFRDBWBM-UHFFFAOYSA-N
Instrument Name Hewlett-Packard 6890-5793N or Finnigan MAT95Q or Finnigan MAT90
Ionization Type EI
Literature Reference DOI 10.1002/anie.202003392
Molecular Weight 243.306 g/mol
Reported Formula C15H17NO2
SMILES OC(c1c(cccc1C#N)OC)(C1CC1)C1CC1
SPLASH splash10-0udi-0190000000-5376fc0ced56d45bc7cc
Source of Spectrum ACI-59-SM28-4kj
Wiley ID 1858148