| SpectraBase Spectrum ID |
JXvSxusBzyu |
| Name |
7-[(5-Mercapto-1,3,4-oxadiazol-2-yl)methoxy]-4-propyl-2H-1-benzopyran-2-one |
| Alternate Name(s) |
4-propyl-7-[(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)methoxy]-1-benzopyran-2-one
4-propyl-7-[(2-thioxo-3H-1,3,4-oxadiazol-5-yl)methoxy]chromen-2-one
4-propyl-7-[(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)methoxy]chromen-2-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H14N2O4S |
| InChI |
InChI=1S/C15H14N2O4S/c1-2-3-9-6-14(18)20-12-7-10(4-5-11(9)12)19-8-13-16-17-15(22)21-13/h4-7H,2-3,8H2,1H3,(H,17,22) |
| InChIKey |
WTEOPJIGCBEGJZ-UHFFFAOYSA-N |
| Molecular Weight |
318.347 g/mol |
| SMILES |
Sc1nnc(o1)COc1cc2OC(=O)C=C(c2cc1)CCC |
| SPLASH |
splash10-014i-0009000000-894369447bd5fc11dd8f |
| Source of Spectrum |
F2-45-3955-3b |
| Wiley ID |
1689399 |
![7-[(5-Mercapto-1,3,4-oxadiazol-2-yl)methoxy]-4-propyl-2H-1-benzopyran-2-one](/api/spectrum/JXvSxusBzyu/structure.png?h=300&w=458 "7-[(5-Mercapto-1,3,4-oxadiazol-2-yl)methoxy]-4-propyl-2H-1-benzopyran-2-one")
