| SpectraBase Compound ID | CaTKj9K8crb |
|---|---|
| InChI | InChI=1S/C20H27BrN2O3/c1-14(2)18(20(25)26-3)22-19(24)16-13-23(12-8-4-7-11-21)17-10-6-5-9-15(16)17/h5-6,9-10,13-14,18H,4,7-8,11-12H2,1-3H3,(H,22,24)/t18-/m0/s1 |
| InChIKey | OVJGUFJEFVZXQO-SFHVURJKSA-N |
| Mol Weight | 423.35 g/mol |
| Molecular Formula | C20H27BrN2O3 |
| Exact Mass | 422.120506 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2lyOrw1CK0 |
|---|---|
| Name | 5-bromo AMB-PICA |
| Catalog Number | 29752 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H27BrN2O3 |
| InChI | InChI=1S/C20H27BrN2O3/c1-14(2)18(20(25)26-3)22-19(24)16-13-23(12-8-4-7-11-21)17-10-6-5-9-15(16)17/h5-6,9-10,13-14,18H,4,7-8,11-12H2,1-3H3,(H,22,24)/t18-/m0/s1 |
| InChIKey | OVJGUFJEFVZXQO-SFHVURJKSA-N |
| Molecular Weight | 423.351 g/mol |
| SMILES | N(C(c1c2c(cccc2)[n](c1)CCCCCBr)=O)[C@](C(OC)=O)(C(C)C)[H] |
| SPLASH | splash10-0006-4983000000-ed472eab1b3f4afcbec3 |
| Source of Spectrum | CAY-2023-343-0 |
| Wiley ID | 1888309 |