| SpectraBase Compound ID | 5Ao1J9xHYS |
|---|---|
| InChI | InChI=1S/C22H30N2O3/c1-22(2,3)19(21(26)27)23-20(25)17-14-24(13-15-9-5-4-6-10-15)18-12-8-7-11-16(17)18/h7-8,11-12,14-15,19H,4-6,9-10,13H2,1-3H3,(H,23,25)(H,26,27)/t19-/m1/s1 |
| InChIKey | YFDOZUYCWXTPTF-LJQANCHMSA-N |
| Mol Weight | 370.49 g/mol |
| Molecular Formula | C22H30N2O3 |
| Exact Mass | 370.225643 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 10w4X8oma7y |
|---|---|
| Name | MDMB-CHMICA metabolite M2 |
| Catalog Number | 19316 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H30N2O3 |
| InChI | InChI=1S/C22H30N2O3/c1-22(2,3)19(21(26)27)23-20(25)17-14-24(13-15-9-5-4-6-10-15)18-12-8-7-11-16(17)18/h7-8,11-12,14-15,19H,4-6,9-10,13H2,1-3H3,(H,23,25)(H,26,27)/t19-/m1/s1 |
| InChIKey | YFDOZUYCWXTPTF-LJQANCHMSA-N |
| Molecular Weight | 370.493 g/mol |
| SMILES | N(C(c1c2c([n](c1)CC1CCCCC1)cccc2)=O)[C@](C(O)=O)(C(C)(C)C)[H] |
| SPLASH | splash10-0007-2490000000-9f4cd06d0e20f7ada971 |
| Source of Spectrum | CAY-2023-386-0 |
| Wiley ID | 1888352 |