| SpectraBase Compound ID | A49XCz9Fn6L |
|---|---|
| InChI | InChI=1S/C12H21O4P/c1-8-4-5-11(13)12(6-8)17(14)15-9(2)7-10(3)16-17/h8-10,12H,4-7H2,1-3H3/t8?,9-,10-,12?/m0/s1 |
| InChIKey | SHNGHBPRHDMNBW-QLWZBITOSA-N |
| Mol Weight | 260.27 g/mol |
| Molecular Formula | C12H21O4P |
| Exact Mass | 260.117746 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1nRqqnNmWe |
|---|---|
| Name | Cyclic (1S,3S)-1,3-Dimethyltrimethylene (5-Methyl-2-oxocyclohexyl) Phosphonate |
| Alternate Name(s) | 2-[(4S,6S)-4,6-dimethyl-2-oxido-1,3,2-dioxaphosphorinan-2-yl]-4-methylcyclohexanone 2-[(4S,6S)-4,6-dimethyl-2-oxo-1,3,2$l^{5}-dioxaphosphorinan-2-yl]-4-methyl-1-cyclohexanone 2-[(4S,6S)-4,6-dimethyl-2-oxo-1,3,2$l^{5}-dioxaphosphinan-2-yl]-4-methylcyclohexan-1-one 2-[(4S,6S)-4,6-dimethyl-2-oxo-1,3,2$l^{5}-dioxaphosphinan-2-yl]-4-methyl-cyclohexanone 2-[(4S,6S)-4,6-dimethyl-2-oxidanylidene-1,3,2$l^{5}-dioxaphosphinan-2-yl]-4-methyl-cyclohexan-1-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H21O4P |
| InChI | InChI=1S/C12H21O4P/c1-8-4-5-11(13)12(6-8)17(14)15-9(2)7-10(3)16-17/h8-10,12H,4-7H2,1-3H3/t8?,9-,10-,12?/m0/s1 |
| InChIKey | SHNGHBPRHDMNBW-QLWZBITOSA-N |
| Molecular Weight | 260.270 g/mol |
| SMILES | C1(P2(O[C@@](C)(C[C@@](O2)(C)[H])[H])=O)C(=O)CCC(C1)C |
| SPLASH | splash10-0ldl-6910000000-8e18c24e963d7a137765 |
| Source of Spectrum | J-61-4045-30 |
| Wiley ID | 1263426 |