| SpectraBase Spectrum ID |
AMR3LA0JNyc |
| Name |
(1ar,4ar,7R,7as,7bs)-4-((Tert-butylamino)methyl)-1,1,7-trimethyldecahydro-1H-cyclopropa[E]azulen-4-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
293.271864750 u |
| Formula |
C19H35NO |
| InChI |
InChI=1S/C19H35NO/c1-12-7-8-13-15(12)16-14(18(16,5)6)9-10-19(13,21)11-20-17(2,3)4/h12-16,20-21H,7-11H2,1-6H3/t12-,13-,14-,15-,16-,19?/m1/s1 |
| InChIKey |
SBXLMCXYZZILSE-BDZWFFQZSA-N |
| SMILES |
[C@]1([C@@]2([C@@](CC1)(C(CC[C@@]1([C@]2(C1(C)C)[H])[H])(O)CNC(C)(C)C)[H])[H])(C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936273 |
![(1ar,4ar,7R,7as,7bs)-4-((Tert-butylamino)methyl)-1,1,7-trimethyldecahydro-1H-cyclopropa[E]azulen-4-ol](/api/spectrum/AMR3LA0JNyc/structure.png?h=300&w=458 "(1ar,4ar,7R,7as,7bs)-4-((Tert-butylamino)methyl)-1,1,7-trimethyldecahydro-1H-cyclopropa[E]azulen-4-ol")
