| SpectraBase Spectrum ID |
BSTSfCaGNvB |
| Name |
(RS)-3-[(RS)-(4-Bromophenyl)(hydroxy)methyl]-3-fluoro-1-methylindolin-2-one |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
349.011369824 u |
| Formula |
C16H13BrFNO2 |
| InChI |
InChI=1S/C16H13BrFNO2/c1-19-13-5-3-2-4-12(13)16(18,15(19)21)14(20)10-6-8-11(17)9-7-10/h2-9,14,20H,1H3 |
| InChIKey |
JMIJGGIRZLDUSE-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu QP-5000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.24820/ark.5550190.p011.804 |
| Molecular Weight |
350.187 g/mol |
| Quality |
75 |
| SMILES |
OC(C1(C=2C=CC=CC2N(C1=O)C)F)C1=CC=C(C=C1)Br |
| SPLASH |
splash10-0f89-3900000000-bcc5b8a2088ab196c5a0 |
| Sample Comments |
dr = 68:32 |
| Source of Spectrum |
ARK-2023-27-3e (DOI: 10.24820/ark.5550190.p011.804) |
| Wiley ID |
1911227 |
![(RS)-3-[(RS)-(4-Bromophenyl)(hydroxy)methyl]-3-fluoro-1-methylindolin-2-one](/api/spectrum/BSTSfCaGNvB/structure.png?h=300&w=458 "(RS)-3-[(RS)-(4-Bromophenyl)(hydroxy)methyl]-3-fluoro-1-methylindolin-2-one")
