![Hydroxy-3-[(t-butoxycarbonyl)amino]-1-(chloromethyl)-1,2,6,7,8,9-hexahydro-3H-benz[e]indole](/api/spectrum/AGHF97JSq22/structure.png?h=300&w=458 "Hydroxy-3-[(t-butoxycarbonyl)amino]-1-(chloromethyl)-1,2,6,7,8,9-hexahydro-3H-benz[e]indole")
| SpectraBase Compound ID | GtJtEyy3Ars |
|---|---|
| InChI | InChI=1S/C18H24ClNO3/c1-18(2,3)23-17(22)20-10-11(9-19)16-13-7-5-4-6-12(13)15(21)8-14(16)20/h8,11,21H,4-7,9-10H2,1-3H3 |
| InChIKey | IJFZASGVHCDPRQ-UHFFFAOYSA-N |
| Mol Weight | 337.85 g/mol |
| Molecular Formula | C18H24ClNO3 |
| Exact Mass | 337.144471 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AGHF97JSq22 |
|---|---|
| Name | Hydroxy-3-[(t-butoxycarbonyl)amino]-1-(chloromethyl)-1,2,6,7,8,9-hexahydro-3H-benz[e]indole |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H24ClNO3 |
| InChI | InChI=1S/C18H24ClNO3/c1-18(2,3)23-17(22)20-10-11(9-19)16-13-7-5-4-6-12(13)15(21)8-14(16)20/h8,11,21H,4-7,9-10H2,1-3H3 |
| InChIKey | IJFZASGVHCDPRQ-UHFFFAOYSA-N |
| Molecular Weight | 337.847 g/mol |
| SMILES | Oc1c2CCCCc2c2c(N(C(OC(C)(C)C)=O)CC2CCl)c1 |
| SPLASH | splash10-001i-0292000000-b97b80ad1f8478e8887e |
| Source of Spectrum | K1-2002-1641-7 |
| Synonyms | 3-(tert-Butyloxycarbonyl)-1-chloromethyl-5-hydroxy-1,2,6,7,8,9-hexahydro-3H-benz[e]indole 3-(tert-Butyloxycarbonylamino)-1-chloromethyl-5-hydroxy-1,2,6,7,8,9-hexahydro-3H-benz[e]indole 5-Hydroxy-3-[(t-butoxycarbonyl)]-1-(chloromethyl)-1,2,6,7,8,9-hexahydro-3H-benz[e]indole 1-(chloromethyl)-5-hydroxy-1,2,6,7,8,9-hexahydrobenzo[e]indole-3-carboxylic acid tert-butyl ester tert-Butyl 1-(chloromethyl)-5-hydroxy-1,2,6,7,8,9-hexahydrobenzo[e]indole-3-carboxylate tert-Butyl 1-(chloromethyl)-5-oxidanyl-1,2,6,7,8,9-hexahydrobenzo[e]indole-3-carboxylate |
| Wiley ID | 1522396 |