SpectraBase Spectrum ID |
8HV6Ex07zLE |
Name |
Diiodo-3,4-methylenedioxyamphetamine AC |
Classification |
Methylenedioxyamphetamine designer drug derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
472.898483280 u |
Formula |
C12H13I2NO3 |
InChI |
InChI=1S/C12H13I2NO3/c1-6(15-7(2)16)3-8-9(13)4-10-12(11(8)14)18-5-17-10/h4,6H,3,5H2,1-2H3,(H,15,16) |
InChIKey |
ZCSVDEGVIKWMKP-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
473.049 g/mol |
Nominal Mass |
473 u |
Quality |
926 |
Retention Index |
2760 |
SMILES |
C1=2C(=C(C(=CC2OCO1)I)CC(NC(=O)C)C)I |
SPLASH |
splash10-03dl-7796200000-17564aa5d01702b03bf4 |
Sample Comments |
Iodine position uncertain |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
N-[1-(Diiodo-3,4-methylenedioxyphenyl)propan-2-yl]acetamide |
Technique |
GC/MS |
Wiley ID |
DD2024_004922 |