| SpectraBase Spectrum ID |
1OKdzx2k1IS |
| Name |
5-methyl-1,3-benzodithiol-2-one |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
363.972014320 u |
| Formula |
C16H12O2S4 |
| GC Oven Program |
Oven temp 280oC |
| InChI |
InChI=1S/2C8H6OS2/c2*1-5-2-3-6-7(4-5)11-8(9)10-6/h2*2-4H,1H3 |
| InChIKey |
NRDUMDCGOIXFQW-UHFFFAOYSA-N |
| Inlet Type |
Split |
| Instrument Name |
Agilent 7890A-5975C |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jssc.202200251 |
| Molecular Weight |
364.510 g/mol |
| Quality |
449 |
| SMILES |
C1(=CC2=C(C=C1)SC(S2)=O)C.C1(=CC2=C(C=C1)SC(S2)=O)C |
| SPLASH |
splash10-0udi-1900000000-d6dd9250598768144b62 |
| Source of Spectrum |
SEP-45-2974-FIGURE 4 (DOI: 10.1002/jssc.202200251) |
| Wiley ID |
1899060 |
