| SpectraBase Spectrum ID |
8HOugAB9wh6 |
| Name |
alpha,beta-Dideuteromescaline N,N-bis(3-bromobenzyl) |
| Classification |
Deuterated reference standard derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
549.048323222 u |
| Formula |
C25H25D2Br2NO3 |
| InChI |
InChI=1S/C25H27Br2NO3/c1-29-23-14-18(15-24(30-2)25(23)31-3)10-11-28(16-19-6-4-8-21(26)12-19)17-20-7-5-9-22(27)13-20/h4-9,12-15H,10-11,16-17H2,1-3H3/i10D,11D |
| InChIKey |
FPTYWGXRRQBFRP-MIBQVNFTSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
551.315 g/mol |
| Nominal Mass |
549 u |
| Quality |
996 |
| Retention Index |
3845 |
| SMILES |
C=1(C(C(N(CC=2C=C(C=CC2)Br)CC2=CC(=CC=C2)Br)[D])[D])C=C(C(=C(C1)OC)OC)OC |
| SPLASH |
splash10-01b9-3906000000-b59c31a92beccaeabaf4 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N,N-Bis(3-bromobenzyl)alpha,beta-dideuteromescaline
N,N-Bis(3-bromobenzyl)-2-(3,4,5-trimethoxyphenyl)(1,2-2H2)ethan-1-amine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_021022 |
