| SpectraBase Spectrum ID |
LCUgORWFNLy |
| Name |
2-[(4-Chloro-2,5-dimethoxyphenyl)imino]-4-methylene-3-thia-1-azaspiro-[4.5]decane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
352.101226796 u |
| Formula |
C17H21ClN2O2S |
| InChI |
InChI=1S/C17H21ClN2O2S/c1-11-17(7-5-4-6-8-17)20-16(23-11)19-13-10-14(21-2)12(18)9-15(13)22-3/h9-10H,1,4-8H2,2-3H3,(H,19,20) |
| InChIKey |
GMTJOYJAVFWCLL-UHFFFAOYSA-N |
| Molecular Weight |
352.880 g/mol |
| SMILES |
N1\C(SC(C11CCCCC1)=C)=N\C1=C(C=C(C(=C1)OC)Cl)OC |
| Spectrum/Structure Validation Score (Raman) |
0.851681 |
![2-[(4-Chloro-2,5-dimethoxyphenyl)imino]-4-methylene-3-thia-1-azaspiro-[4.5]decane](/api/spectrum/LCUgORWFNLy/structure.png?h=300&w=458 "2-[(4-Chloro-2,5-dimethoxyphenyl)imino]-4-methylene-3-thia-1-azaspiro-[4.5]decane")
