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1-Adamantyl isocyanate
SpectraBase Compound ID AeMQ7NENFv5
InChI InChI=1S/C11H15NO/c13-7-12-11-4-8-1-9(5-11)3-10(2-8)6-11/h8-10H,1-6H2/t8-,9+,10-,11-
InChIKey VBHCPGFCIQDXGZ-BIBSGERRSA-N
Mol Weight 177.25 g/mol
Molecular Formula C11H15NO
Exact Mass 177.115364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID He0aH9oY8HT
Name 1-Adamantyl isocyanate
CAS Registry Number 4411-25-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H15NO
InChI InChI=1S/C11H15NO/c13-7-12-11-4-8-1-9(5-11)3-10(2-8)6-11/h8-10H,1-6H2/t8-,9+,10-,11-
InChIKey VBHCPGFCIQDXGZ-BIBSGERRSA-N
Molecular Weight 177.247 g/mol
SMILES C1[C@]2(CC3(C[C@@]1(C[C@](C3)(C2)[H])[H])N=C=O)[H]
SPLASH splash10-00di-0900000000-d772dfccf864619f3b0c
Source of Spectrum J-55-4283-1
Synonyms 1-Isocyanatoadamantane Adamantane, 1-isocyanato- Adamantyl isocyanate
Wiley ID 1173374