SpectraBase Compound ID | Gyx6LLuxpM0 |
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InChI | InChI=1S/C8H10N2O/c1-5-6-3-2-4-7(6)10-8(11)9-5/h2-4H2,1H3,(H,9,10,11) |
InChIKey | KQUXCKYKMCJICY-UHFFFAOYSA-N |
Mol Weight | 150.18 g/mol |
Molecular Formula | C8H10N2O |
Exact Mass | 150.079313 g/mol |
SpectraBase Spectrum ID | BRHLSeeWvx7 |
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Name | 6,7-Dihydro-4-methyl-1H-cyclopentapyrimidin-2(5H)-one |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 150.079312949 u |
Formula | C8H10N2O |
InChI | InChI=1S/C8H10N2O/c1-5-6-3-2-4-7(6)10-8(11)9-5/h2-4H2,1H3,(H,9,10,11) |
InChIKey | KQUXCKYKMCJICY-UHFFFAOYSA-N |
SMILES | CC=1C=2CCCC2NC(N1)=O |
Spectrum/Structure Validation Score (Raman) | 0.738852 |