| SpectraBase Compound ID | EAqwUGpIZ4p |
|---|---|
| InChI | InChI=1S/C6H6N4O2/c1-10-5(11)3-4(8-2-7-3)9-6(10)12/h2H,1H3,(H,7,8)(H,9,12) |
| InChIKey | MVOYJPOZRLFTCP-UHFFFAOYSA-N |
| Mol Weight | 166.14 g/mol |
| Molecular Formula | C6H6N4O2 |
| Exact Mass | 166.049075 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 5mJwDcsmSn1 |
|---|---|
| Name | 1-METHYLXANTHINE |
| Source of Sample | Fluka Chemie AG, Buchs, Switzerland |
| CAS Registry Number | 6136-37-4 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H6N4O2 |
| InChI | InChI=1S/C6H6N4O2/c1-10-5(11)3-4(8-2-7-3)9-6(10)12/h2H,1H3,(H,7,8)(H,9,12) |
| InChIKey | MVOYJPOZRLFTCP-UHFFFAOYSA-N |
| Molecular Weight | 166.139240 |
| Synonyms | XANTHINE, 1-METHYL-, |
| Technique | KBr WAFER |