| SpectraBase Spectrum ID |
KMB1CBiquBQ |
| Name |
(2S)-2-(4-fluorophenyl)-4-(2,3,4-trimethoxyphenyl)-2,3-dihydro-1,5-benzothiazepine |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H22FNO3S |
| InChI |
InChI=1S/C24H22FNO3S/c1-27-20-13-12-17(23(28-2)24(20)29-3)19-14-22(15-8-10-16(25)11-9-15)30-21-7-5-4-6-18(21)26-19/h4-13,22H,14H2,1-3H3/t22-/m0/s1 |
| InChIKey |
IAEVJDLTZBVLSM-QFIPXVFZSA-N |
| Instrument Name |
AEI MS 30 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1016/j.arabjc.2013.12.024 |
| Molecular Weight |
423.502 g/mol |
| SMILES |
c1(F)ccc(cc1)[C@]1(Sc2c(N=C(C1)c1c(c(c(cc1)OC)OC)OC)cccc2)[H] |
| SPLASH |
splash10-0006-1900000000-5b7a2415ac6ab23207de |
| Source of Spectrum |
AJC-10-S3257-4d |
| Wiley ID |
1857221 |
