| SpectraBase Spectrum ID |
2ndV3wcngQq |
| Name |
1-(2-Chlorophenyl)-2-nitroprop-1-ene benzaldehyde Adduct |
| Classification |
Designer drug side product |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
337.027248680 u |
| Formula |
C16H13Cl2NO3 |
| InChI |
InChI=1S/C16H13Cl2NO3/c1-10(19(21)22)15(11-6-2-4-8-13(11)17)16(20)12-7-3-5-9-14(12)18/h2-10,15H,1H3 |
| InChIKey |
GJOGPALHBILJJY-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
338.190 g/mol |
| Nominal Mass |
337 u |
| Quality |
993 |
| Retention Index |
2441 |
| SMILES |
C(C1=C(C=CC=C1)Cl)(C(C=1C(=CC=CC1)Cl)=O)C([N+](=O)[O-])C |
| SPLASH |
splash10-03dr-2690000000-d457265ca85b34262951 |
| Sample Comments |
Structure uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1,2-Bis(2-chlorophenyl)-3-nitrobutan-1-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000597 |
