SpectraBase Spectrum ID |
8JLLvAzwvRI |
Name |
Penicillamine-A (-C2H2S) AC |
Classification |
Pharmaceutical drug artifact derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
139.063328532 u |
Formula |
C7H9NO2 |
InChI |
InChI=1S/C7H9NO2/c1-5-3-10-4-7(5)8-6(2)9/h3-4H,1-2H3,(H,8,9) |
InChIKey |
XKELDXQDVNLBSF-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
139.154 g/mol |
Nominal Mass |
139 u |
Quality |
991 |
Retention Index |
1068 |
SMILES |
C=1(NC(=O)C)C(=COC1)C |
SPLASH |
splash10-0006-9100000000-75a42b51f7fb9fcc8955 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
N-(4-methylfuran-3-yl)acetamide |
Technique |
GC/MS |
Wiley ID |
DD2024_011090 |