SpectraBase Spectrum ID |
838RbbXqm0Z |
Name |
[cyclopropyl-(4-methoxyphenyl)methyl]imino-methyl-oxo-phenyl-.lambda.6-sulfane |
Appearance |
Yellow viscous oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
315.129300092 u |
Formula |
C18H21NO2S |
InChI |
InChI=1S/C18H21NO2S/c1-21-16-12-10-15(11-13-16)18(14-8-9-14)19-22(2,20)17-6-4-3-5-7-17/h3-7,10-14,18H,8-9H2,1-2H3 |
InChIKey |
IGHHJFXGUSBFAC-UHFFFAOYSA-N |
Instrument Name |
Finnigan SSQ 7000 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/anie.201801660 |
Molecular Weight |
315.431 g/mol |
Quality |
251 |
Reported Formula |
C18H21NO2S |
SMILES |
C1(S(=NC(C2=CC=C(C=C2)OC)C2CC2)(C)=O)=CC=CC=C1 |
SPLASH |
splash10-0096-4930000000-03a5f8e8815e01d52fa3 |
Sample Comments |
dr = 1:1 |
Source of Spectrum |
ACI-57-SM15-3y (DOI: 10.1002/anie.201801660) |
Wiley ID |
1890897 |