| SpectraBase Spectrum ID |
E9pIeSJFtsT |
| Name |
Spiro[cyclopentane-2-(1,3,4,5-Tetrahydro-3-benzothiepin)] |
| Comments |
Less than 3 mono-isotopic peaks; Note: The molecular formula of the structure shown is C15H19 - which differs from the formula reported for the mass spectrum (C14H18S) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H18S |
| InChI |
InChI=1S/C15H19/c1-2-6-14-8-12-15(9-3-4-10-15)11-7-13(14)5-1/h1-2,5-6,11H,3-4,7-10,12H2 |
| InChIKey |
ZMWBHUCKLZJQKN-UHFFFAOYSA-N |
| Molecular Weight |
199.317 g/mol |
| SMILES |
C1[C]2(CCC1)=CCc1c(CC2)cccc1 |
| SPLASH |
splash10-014i-0950000000-d0e287be3d9285b4b4f8 |
| Source of Spectrum |
J-61-1862-10 |
| Wiley ID |
1218087 |
![Spiro[cyclopentane-2-(1,3,4,5-Tetrahydro-3-benzothiepin)]](/api/spectrum/E9pIeSJFtsT/structure.png?h=300&w=458 "Spiro[cyclopentane-2-(1,3,4,5-Tetrahydro-3-benzothiepin)]")
