| SpectraBase Spectrum ID |
BWKCtLNPa9S |
| Name |
1,3-Isobenzofurandione, 3A,4,7,7A-tetrahydro-4-(1H-indol-3-yl)-, (3A.alpha.,4.beta.,7A.alpha.)-(.+-.)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
267.089543280 u |
| Formula |
C16H13NO3 |
| InChI |
InChI=1S/C16H13NO3/c18-15-11-6-3-5-10(14(11)16(19)20-15)12-8-17-13-7-2-1-4-9(12)13/h1-5,7-8,10-11,14,17H,6H2/t10-,11-,14+/m1/s1 |
| InChIKey |
WSANHMYRIXFLGB-GYSYKLTISA-N |
| Molecular Weight |
267.284 g/mol |
| SMILES |
C1(OC(=O)[C@]2([C@@]1([C@@](C1=CNC3=C1C=CC=C3)(C=CC2)[H])[H])[H])=O |
