| SpectraBase Spectrum ID |
1UmmQdhORMC |
| Name |
Busulfan |
| Source of Sample |
Sigma-Aldrich Cat. #B2635 |
| CAS Registry Number |
55-98-1 |
| Classification |
Pesticides |
| Copyright |
Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
246.023180513 u |
| Formula |
C6H14O6S2 |
| InChI |
InChI=1S/C6H14O6S2/c1-13(7,8)11-5-3-4-6-12-14(2,9)10/h3-6H2,1-2H3 |
| InChIKey |
COVZYZSDYWQREU-UHFFFAOYSA-N |
| Molecular Weight |
246.292 g/mol |
| Number of Peaks |
113 |
| RI1 |
1848 |
| SMILES |
CS(=O)(=O)OCCCCOS(C)(=O)=O |
| SPLASH |
splash10-00bc-9100000000-6890eead6f113d96b0b9 |
| Sample Comments |
RI1: measured on SLB-5ms (Alkanes)
RI2: measured on Equity-1 (Alkanes) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
1,4-Butanediol, 1,4-dimethanesulfonate |
| Wiley ID |
LM_PEST_456 |
