| SpectraBase Spectrum ID |
Es6X06OLYqU |
| Name |
1H-Indole, 3-ethyl-2,3-dihydro-2-methyl-, cis- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
161.120449487 u |
| Formula |
C11H15N |
| InChI |
InChI=1S/C11H15N/c1-3-9-8(2)12-11-7-5-4-6-10(9)11/h4-9,12H,3H2,1-2H3/t8-,9+/m1/s1 |
| InChIKey |
YQTHBLHVUIPAEY-BDAKNGLRSA-N |
| Molecular Weight |
161.248 g/mol |
| SMILES |
C1=2N[C@@]([C@@](C2C=CC=C1)(CC)[H])(C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.945575 |
