SpectraBase Spectrum ID |
66t4TzsNFm3 |
Name |
3-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]phenol |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H13N3O3S |
InChI |
InChI=1S/C16H13N3O3S/c20-12-3-1-2-10(8-12)15-17-18-16(23)19(15)11-4-5-13-14(9-11)22-7-6-21-13/h1-5,8-9,20H,6-7H2,(H,18,23) |
InChIKey |
JEKIFNSXQFSNHX-UHFFFAOYSA-N |
Molecular Weight |
327.358 g/mol |
SMILES |
Sc1nnc(-c2cc(O)ccc2)[n]1-c1cc2OCCOc2cc1 |
SPLASH |
splash10-004i-9724000000-fd3e928c7781d337c708 |
Source of Spectrum |
IY-2-4750-6 |
Synonyms |
Phenol, 3-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-mercapto-4H-1,2,4-triazol-3-yl]- |
Wiley ID |
1655489 |