SpectraBase Compound ID | KXnghSDYen1 |
---|---|
InChI | InChI=1S/C7H8N2OS/c8-7(11)9-5-2-1-3-6(10)4-5/h1-4,10H,(H3,8,9,11) |
InChIKey | BHJYKFUCQNISJA-UHFFFAOYSA-N |
Mol Weight | 168.21 g/mol |
Molecular Formula | C7H8N2OS |
Exact Mass | 168.035734 g/mol |
SpectraBase Spectrum ID | DzuCON59sKL |
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Name | 1-(m-Hydroxyphenyl)-2-thiourea |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 168.035734059 u |
Formula | C7H8N2OS |
InChI | InChI=1S/C7H8N2OS/c8-7(11)9-5-2-1-3-6(10)4-5/h1-4,10H,(H3,8,9,11) |
InChIKey | BHJYKFUCQNISJA-UHFFFAOYSA-N |
SMILES | OC=1C=CC=C(C1)NC(N)=S |
Spectrum/Structure Validation Score (Raman) | 0.963011 |