SpectraBase Spectrum ID |
7vCl4ql3w4A |
Name |
Spiro[cyclopentane-1,3'-[3H]indole], 2'-methyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
185.120449487 u |
Formula |
C13H15N |
InChI |
InChI=1S/C13H15N/c1-10-13(8-4-5-9-13)11-6-2-3-7-12(11)14-10/h2-3,6-7H,4-5,8-9H2,1H3 |
InChIKey |
AYKQOEYKUZBLTL-UHFFFAOYSA-N |
Molecular Weight |
185.270 g/mol |
SMILES |
C=1(C)C2(C3=CC=CC=C3N1)CCCC2 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.908962 |