| SpectraBase Compound ID | FgPCSowQ55H |
|---|---|
| InChI | InChI=1S/C19H25N5O2/c1-19(2,3)16(17(21)25)22-18(26)15-13-9-5-6-10-14(13)24(23-15)12-8-4-7-11-20/h5-6,9-10,16H,4,7-8,12H2,1-3H3,(H2,21,25)(H,22,26) |
| InChIKey | NJHAOEDIIRSZHL-UHFFFAOYSA-N |
| Mol Weight | 355.44 g/mol |
| Molecular Formula | C19H25N5O2 |
| Exact Mass | 355.200825 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7viYvIUW9jh |
|---|---|
| Name | 4-cyano ADB-BUTINACA |
| Catalog Number | 26506 |
| Alternate Name(s) | 4CN-ADB-BINACA 4CN-ADB-BUTINACA |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H25N5O2 |
| InChI | InChI=1S/C19H25N5O2/c1-19(2,3)16(17(21)25)22-18(26)15-13-9-5-6-10-14(13)24(23-15)12-8-4-7-11-20/h5-6,9-10,16H,4,7-8,12H2,1-3H3,(H2,21,25)(H,22,26) |
| InChIKey | NJHAOEDIIRSZHL-UHFFFAOYSA-N |
| Molecular Weight | 355.442 g/mol |
| SMILES | N(C(=O)c1n[n](CCCCC#N)c2c1cccc2)C(C(N)=O)C(C)(C)C |
| SPLASH | splash10-004i-1493000000-ab6a1e0d978118e94f32 |
| Source of Spectrum | CAY-2023-194-0 |
| Wiley ID | 1888160 |