SpectraBase Spectrum ID |
KHmI0Ey0tBi |
Name |
(7R,8S,8as)-8-( 4'-Methylbenzylideneamino)-7-isopropyl indolizidine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
284.225248910 u |
Formula |
C19H28N2 |
InChI |
InChI=1S/C19H28N2/c1-14(2)17-10-12-21-11-4-5-18(21)19(17)20-13-16-8-6-15(3)7-9-16/h6-9,13-14,17-19H,4-5,10-12H2,1-3H3/b20-13+/t17-,18+,19+/m1/s1 |
InChIKey |
OCGVYWCUIKQBER-LRFLBPIYSA-N |
SMILES |
[C@]1(\N=C\C2=CC=C(C=C2)C)([C@]2(N(CCC2)CC[C@@]1(C(C)C)[H])[H])[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.916688 |