| SpectraBase Spectrum ID |
8FaV2GsEPRY |
| Name |
1-(Indolyl-3)-2-nitroprop-1-ene AC I |
| Classification |
Designer drug precursor |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
244.084792251 u |
| Formula |
C13H12N2O3 |
| InChI |
InChI=1S/C13H12N2O3/c1-9(15(17)18)7-11-8-14(10(2)16)13-6-4-3-5-12(11)13/h3-8H,1-2H3/b9-7- |
| InChIKey |
UISGIULTTSNPKI-CLFYSBASSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
244.250 g/mol |
| Nominal Mass |
244 u |
| Quality |
983 |
| Retention Index |
1936 |
| SMILES |
C=12C(N(C=C2\C=C\([N+](=O)[O-])C)C(=O)C)=CC=CC1 |
| SPLASH |
splash10-0f96-3920000000-9f0c66eafd05cf6ea7b0 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-(3-(2-nitroprop-1-en-1-yl)-1H-indol-1-yl)ethan-1-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_001738 |
