SpectraBase Compound ID | 3aYOfmwjll1 |
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InChI | InChI=1S/C18H24O2/c19-5-6-20-17-3-1-16(2-4-17)18-10-13-7-14(11-18)9-15(8-13)12-18/h1-4,13-15,19H,5-12H2/t13-,14+,15-,18- |
InChIKey | WKFXDHXJLMIZIS-OVMOHIIOSA-N |
Mol Weight | 272.39 g/mol |
Molecular Formula | C18H24O2 |
Exact Mass | 272.17763 g/mol |
SpectraBase Spectrum ID | 26yrumRQtN6 |
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Name | 2-[p-(Adamantyl-1)phenoxy]ethanol |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 272.177630011 u |
Formula | C18H24O2 |
InChI | InChI=1S/C18H24O2/c19-5-6-20-17-3-1-16(2-4-17)18-10-13-7-14(11-18)9-15(8-13)12-18/h1-4,13-15,19H,5-12H2/t13-,14+,15-,18- |
InChIKey | WKFXDHXJLMIZIS-OVMOHIIOSA-N |
SMILES | [C@]12(CC3(C[C@](C2)(C[C@](C1)(C3)[H])[H])C=1C=CC(=CC1)OCCO)[H] |