SpectraBase Spectrum ID |
DsaAV2CdkY7 |
Name |
1H-Indol-5-amine, 2,3-dihydro-1,3,3-trimethyl-2-methylene-; indoline, 5-amino-1,3,3-trimethyl-2-methylene- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
188.131348523 u |
Formula |
C12H16N2 |
InChI |
InChI=1S/C12H16N2/c1-8-12(2,3)10-7-9(13)5-6-11(10)14(8)4/h5-7H,1,13H2,2-4H3 |
InChIKey |
WHPVQSTYFPPYCQ-UHFFFAOYSA-N |
Molecular Weight |
188.274 g/mol |
SMILES |
NC1=CC=2C(C(N(C2C=C1)C)=C)(C)C |
Spectrum/Structure Validation Score (Raman) |
0.817069 |