SpectraBase Spectrum ID |
lNDoi6E2K5 |
Name |
[(1R,2R,4S)-3-Isopropyl-3-azabicyclo[2.2.1]heptan-2-yl]methanol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
169.146664235 u |
Formula |
C10H19NO |
InChI |
InChI=1S/C10H19NO/c1-7(2)11-9-4-3-8(5-9)10(11)6-12/h7-10,12H,3-6H2,1-2H3/t8-,9+,10-/m1/s1 |
InChIKey |
BTVUSALZDDJPFW-KXUCPTDWSA-N |
Molecular Weight |
169.268 g/mol |
SMILES |
[C@@]12(N([C@@]([C@@](C2)(CC1)[H])(CO)[H])C(C)C)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.818826 |