| SpectraBase Compound ID | 4nbR4oBITcf |
|---|---|
| InChI | InChI=1S/C10H13BrO/c11-9-6-1-5-2-7(4-6)10(12)8(9)3-5/h5-9H,1-4H2/t5-,6+,7-,8+,9+/m0/s1 |
| InChIKey | FTYOJSPBIJRJOB-KVEIKIFDSA-N |
| Mol Weight | 229.12 g/mol |
| Molecular Formula | C10H13BrO |
| Exact Mass | 228.014978 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4OkfUCPOIRG |
|---|---|
| Name | 2-Adamantanone, 4-bromo-, stereoisomer |
| Alternate Name(s) | 4-Bromo-2-adamantanone Tricyclo[3.3.1.1(3,7)]decan-2-one, 4-bromo- 4-Bromoadamantan-2-one 4-Bromanyladamantan-2-one Tricyclo[3.3.1.1(3,7)]decan-2-one, 4-bromo-, stereoisomer Tricyclo[3.3.1.1(3,7)]decanone, 4-bromo- Tricyclo[3.3.1.1(3,7)]decanone, 4-bromo-, (1.alpha.,3.beta.,4.alpha.,5.alpha.,7.beta.)- Tricyclo[3.3.1.1(3,7)]decanone, 4-bromo-, (1.alpha.,3.beta.,4.beta.,5.alpha.,7.beta.)- Tricyclo[3.3.1.1(3,7)]decanone, 4-bromo-, stereoisomer |
| CAS Registry Number | 19213-98-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H13BrO |
| InChI | InChI=1S/C10H13BrO/c11-9-6-1-5-2-7(4-6)10(12)8(9)3-5/h5-9H,1-4H2/t5-,6+,7-,8+,9+/m0/s1 |
| InChIKey | FTYOJSPBIJRJOB-KVEIKIFDSA-N |
| Molecular Weight | 229.117 g/mol |
| SMILES | C1[C@]2([C@]([C@@]3(C([C@](C2)(C[C@]1(C3)[H])[H])=O)[H])(Br)[H])[H] |
| SPLASH | splash10-00bd-9400000000-1990ee01cf23ac7c609d |
| Source of Spectrum | CM-1999-22161-0 |
| Wiley ID | 484515 |