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

*Links on SpectraBase are not permalinks.
(S)-2-(Isopropoxy(3-methoxyphenyl)methyl)-N-methylaniline
SpectraBase Compound ID 6fm4qqG6Vi4
InChI InChI=1S/C18H23NO2/c1-13(2)21-18(14-8-7-9-15(12-14)20-4)16-10-5-6-11-17(16)19-3/h5-13,18-19H,1-4H3/t18-/m0/s1
InChIKey DQILMZVPUZREPH-SFHVURJKSA-N
Mol Weight 285.39 g/mol
Molecular Formula C18H23NO2
Exact Mass 285.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 2xixiMxmIS
Name (S)-2-(Isopropoxy(3-methoxyphenyl)methyl)-N-methylaniline
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 285.172878983 u
Formula C18H23NO2
InChI InChI=1S/C18H23NO2/c1-13(2)21-18(14-8-7-9-15(12-14)20-4)16-10-5-6-11-17(16)19-3/h5-13,18-19H,1-4H3/t18-/m0/s1
InChIKey DQILMZVPUZREPH-SFHVURJKSA-N
Instrument Name Shimadzu GC-MS QP2010
Ionization Type EI
Literature Reference DOI 10.1002/anie.201511179
Molecular Weight 285.387 g/mol
Optical Rotation [a]D(RT) = -8.0 (c = 0.3, CHCl3)
Quality 161
Reported Formula C18H23NO2
SMILES N(C1=C([C@@](OC(C)C)(C2=CC(=CC=C2)OC)[H])C=CC=C1)C
SPLASH splash10-006x-2790000000-2a8db2c2cd29c974ec60
Sample Comments 95% ee
Source of Spectrum ACI-55-SM15-3c (DOI: 10.1002/anie.201511179)
Wiley ID 1897286