| SpectraBase Compound ID | LMJgocuLP6D |
|---|---|
| InChI | InChI=1S/C22H32N2O/c1-13-9-15-10-14(2)22(4,24-12-25)18-6-5-17-20(19(15)18)16(13)7-8-21(17,3)11-23/h13-20H,5-10H2,1-4H3/t13-,14+,15-,16+,17-,18-,19+,20+,21+,22+/m0/s1 |
| InChIKey | ZBECQDDSFJDUHU-OWDQLYIKSA-N |
| Mol Weight | 340.5 g/mol |
| Molecular Formula | C22H32N2O |
| Exact Mass | 340.251464 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 2FppBT7EQ4 |
|---|---|
| Name | (1S,3aR,4S,5aS,7R,8R,8aS,10aS,10bS,10cS)-8-isocyanato-1,4,7,8-tetramethyl-2,3,3a,4,5,5a,6,7,8a,9,10,10a,10b,10c-tetradecahydropyrene-1-carbonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H32N2O |
| InChI | InChI=1S/C22H32N2O/c1-13-9-15-10-14(2)22(4,24-12-25)18-6-5-17-20(19(15)18)16(13)7-8-21(17,3)11-23/h13-20H,5-10H2,1-4H3/t13-,14+,15-,16+,17-,18-,19+,20+,21+,22+/m0/s1 |
| InChIKey | ZBECQDDSFJDUHU-OWDQLYIKSA-N |
| Molecular Weight | 340.511 g/mol |
| SMILES | [C@]12([C@]3([C@@](N=C=O)(C)[C@@](C[C@@]2(C[C@](C)([C@@]2([C@@]1([C@@]([C@](C#N)(C)CC2)(CC3)[H])[H])[H])[H])[H])(C)[H])[H])[H] |
| SPLASH | splash10-05fr-0093000000-6f87b61d5937dee77700 |
| Source of Spectrum | J-61-3261-5 |
| Wiley ID | 1335572 |