SpectraBase Spectrum ID |
3Ak7V6hqYSb |
Name |
2-(Phenylthio)ethyl 5-(4-bromophenoxy)pentanoate |
Appearance |
Colorless oil |
Carrier Gas |
Argon |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
408.039478707 u |
Formula |
C19H21BrO3S |
GC Column |
HP-5 (30 m x 0.32 mm, film thickness 0.25 micrometer) |
InChI |
InChI=1S/C19H21BrO3S/c20-16-9-11-17(12-10-16)22-13-5-4-8-19(21)23-14-15-24-18-6-2-1-3-7-18/h1-3,6-7,9-12H,4-5,8,13-15H2 |
InChIKey |
GJAXHZKUIZADRF-UHFFFAOYSA-N |
Instrument Name |
Agilent HP-7890A-AMD 402 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/anie.202211939 |
Molecular Weight |
409.338 g/mol |
Quality |
221 |
Reported Formula |
C19H21BrO3S |
SMILES |
C1(=CC=CC=C1)SCCOC(CCCCOC1=CC=C(C=C1)Br)=O |
SPLASH |
splash10-052r-2900000000-1c2c3d3419de8836d58e |
Source of Spectrum |
ACI-61-SM53-82 (DOI: 10.1002/anie.202211939) |
Wiley ID |
1899587 |