| SpectraBase Spectrum ID |
1p0uSfzPrry |
| Name |
2-(4-methoxyphenyl)-3-oxidanyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H15NO3S |
| InChI |
InChI=1S/C16H15NO3S/c1-20-11-8-6-10(7-9-11)15-14(18)16(19)17-12-4-2-3-5-13(12)21-15/h2-9,14-15,18H,1H3,(H,17,19) |
| InChIKey |
LHBHZALHFIQJGJ-UHFFFAOYSA-N |
| Molecular Weight |
301.360 g/mol |
| SMILES |
N1c2c(SC(C(C1=O)O)c1ccc(cc1)OC)cccc2 |
| SPLASH |
splash10-001i-0092000000-840b3744296e129b03e9 |
| Source of Spectrum |
C4-33-889-5 |
| Synonyms |
3-hydroxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-one
3-hydroxy-2-(4-methoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one |
| Wiley ID |
1520158 |
