| SpectraBase Spectrum ID |
58P1zNkjc1o |
| Name |
14-Oxo-2,7-dioxa-13-thiapentacyclo[6.4.1.1(9,12).0(3,11).0(6,10)]tetradecane |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H12O3S |
| InChI |
InChI=1S/C11H12O3S/c12-9-7-5-3-1-2-4-6(5)8(9)11(14-4)15-10(7)13-3/h3-8,10-11H,1-2H2/t3-,4?,5?,6-,7-,8+,10+,11-/m1/s1 |
| InChIKey |
NTBNVAMVRUVRKF-UHFFFAOYSA-N |
| Molecular Weight |
224.274 g/mol |
| SMILES |
[C@]12(O[C@@]3(CCC4O[C@@]([C@]5([C@]4(C3[C@@]1(C5=O)[H])[H])[H])(S2)[H])[H])[H] |
| SPLASH |
splash10-001i-9030000000-438b405b9501086afe6c |
| Source of Spectrum |
J-66-4616-37 |
| Synonyms |
4,14-dioxa-2-thiapentacyclo[6.5.1.0(3,11).0(5,10).0(9,13)]tetradecan-12-one |
| Wiley ID |
1535504 |
![14-Oxo-2,7-dioxa-13-thiapentacyclo[6.4.1.1(9,12).0(3,11).0(6,10)]tetradecane](/api/spectrum/58P1zNkjc1o/structure.png?h=300&w=458 "14-Oxo-2,7-dioxa-13-thiapentacyclo[6.4.1.1(9,12).0(3,11).0(6,10)]tetradecane")
