SpectraBase Compound ID | 1MkjlIQ4Vs8 |
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InChI | InChI=1S/C17H22O/c1-11-2-3-16(18)15(4-11)17-8-12-5-13(9-17)7-14(6-12)10-17/h2-4,12-14,18H,5-10H2,1H3/t12-,13+,14-,17- |
InChIKey | XHLJIHBDAJFXBE-ZZNDEYBLSA-N |
Mol Weight | 242.36 g/mol |
Molecular Formula | C17H22O |
Exact Mass | 242.167065 g/mol |
SpectraBase Spectrum ID | FxCsnE53vQQ |
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Name | 2-(1-Adamantyl)-4-methylphenol |
Source of Sample | Sigma-Aldrich Co. LLC. |
Catalog Number | 394688 |
CAS Registry Number | 41031-50-9 |
Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C17H22O |
InChI | InChI=1S/C17H22O/c1-11-2-3-16(18)15(4-11)17-8-12-5-13(9-17)7-14(6-12)10-17/h2-4,12-14,18H,5-10H2,1H3/t12-,13+,14-,17- |
InChIKey | XHLJIHBDAJFXBE-ZZNDEYBLSA-N |
Observed nucleus | 13C |
Purity | 99% |
Solvent | CDCl3 |
Source of Spectrum | Sigma-Aldrich Co. LLC. |
Wiley ID | SIAL_13CNMR_008718 |