SpectraBase Spectrum ID |
EK87i2rrvIz |
Name |
1-Nonene, 4-methoxy-3-methyl-, (R*,R*)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
170.167065327 u |
Formula |
C11H22O |
InChI |
InChI=1S/C11H22O/c1-5-7-8-9-11(12-4)10(3)6-2/h6,10-11H,2,5,7-9H2,1,3-4H3/t10-,11-/m1/s1 |
InChIKey |
NKHATLUWZARHJA-GHMZBOCLSA-N |
Molecular Weight |
170.296 g/mol |
SMILES |
C(=C)[C@]([C@](OC)(CCCCC)[H])(C)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.956727 |