| SpectraBase Spectrum ID |
4XHdrXD6KET |
| Name |
1,7-Dimethyl-10-anti-formyl-2,6,13-trioxa-4-thiapentacyclo[5.5.1.0(3,11).0(5,9).0(8,12)]tridecane |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H14O4S |
| InChI |
InChI=1S/C12H14O4S/c1-11-7-5-4(3-13)6-8(7)12(2,16-11)15-10(6)17-9(5)14-11/h3-10H,1-2H3 |
| InChIKey |
GRNQJOWDWWCWGA-UHFFFAOYSA-N |
| Molecular Weight |
254.300 g/mol |
| SMILES |
C12(OC3SC4OC(C5C4C(C3C15)C=O)(O2)C)C |
| SPLASH |
splash10-004i-0090000000-2a74af13c06d26896339 |
| Source of Spectrum |
J-66-4617-54 |
| Synonyms |
1,11-dimethyl-10,12,13-trioxa-8-thiapentacyclo[5.5.1.0(2,6).0(3,11).0(4,9)]tridecane-5-carbaldehyde |
| Wiley ID |
1535499 |
![1,7-Dimethyl-10-anti-formyl-2,6,13-trioxa-4-thiapentacyclo[5.5.1.0(3,11).0(5,9).0(8,12)]tridecane](/api/spectrum/4XHdrXD6KET/structure.png?h=300&w=458 "1,7-Dimethyl-10-anti-formyl-2,6,13-trioxa-4-thiapentacyclo[5.5.1.0(3,11).0(5,9).0(8,12)]tridecane")
