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1-Adamantyl)(isocyanato)methylbenzene
SpectraBase Compound ID LRqcYNL4erz
InChI InChI=1S/C18H21NO/c20-12-19-17(16-4-2-1-3-5-16)18-9-13-6-14(10-18)8-15(7-13)11-18/h1-5,13-15,17H,6-11H2/t13-,14+,15-,17?,18-
InChIKey QHWMXZXRHFXLGZ-LOEUTXMCSA-N
Mol Weight 267.37 g/mol
Molecular Formula C18H21NO
Exact Mass 267.162314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9x1a6Mvttlj
Name 1-Adamantyl)(isocyanato)methylbenzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NO
InChI InChI=1S/C18H21NO/c20-12-19-17(16-4-2-1-3-5-16)18-9-13-6-14(10-18)8-15(7-13)11-18/h1-5,13-15,17H,6-11H2/t13-,14+,15-,17?,18-
InChIKey QHWMXZXRHFXLGZ-LOEUTXMCSA-N
Molecular Weight 267.372 g/mol
SMILES C12(C(N=C=O)c3ccccc3)C[C@]3(C[C@@](C1)(C[C@@](C2)(C3)[H])[H])[H]
SPLASH splash10-0a4i-0900000000-10ccf6938cf54bcf67e9
Source of Spectrum O1-47-606-3b
Wiley ID 1669522