| SpectraBase Spectrum ID |
B1SxncIQGcy |
| Name |
1-Chlorododecane |
| CAS Registry Number |
112-52-7 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
204.164478505 u |
| Formula |
C12H25Cl |
| InChI |
InChI=1S/C12H25Cl/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2-12H2,1H3 |
| InChIKey |
YAYNEUUHHLGGAH-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
204.785 g/mol |
| Nominal Mass |
204 u |
| Quality |
986 |
| Retention Index |
1676 |
| SMILES |
C(CCCCCC)CCCCCCl |
| SPLASH |
splash10-052f-9000000000-eec076c055d86c389286 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-chlorododecane |
| Technique |
GC/MS |
| Wiley ID |
DD2024_006938 |
