| SpectraBase Spectrum ID |
J0mTC7YX0GJ |
| Name |
4-Oxo-2-adamantanecarbonitrile |
| Alternate Name(s) |
4-ketoadamantane-2-carbonitrile
4-Oxidanylideneadamantane-2-carbonitrile
4-Oxoadamantane-2-carbonitrile
Adamantane-2-carbonitrile, 4-oxo- |
| CAS Registry Number |
77172-06-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H13NO |
| InChI |
InChI=1S/C11H13NO/c12-5-10-7-1-6-2-8(4-7)11(13)9(10)3-6/h6-10H,1-4H2/t6-,7+,8-,9+,10?/m1/s1 |
| InChIKey |
CIDMJAUKOQQHLO-WUQLENLQSA-N |
| Molecular Weight |
175.231 g/mol |
| SMILES |
[C@]12(C([C@@]3(C[C@](C2)(C[C@](C1C#N)(C3)[H])[H])[H])=O)[H] |
| SPLASH |
splash10-004i-9300000000-ab8234c90d019a9ace8a |
| Source of Spectrum |
AD-0-2532-0 |
| Wiley ID |
1420415 |
