SpectraBase Compound ID | HbIp14IXCCG |
---|---|
InChI | InChI=1S/C9H6N2O/c1-12-9-4-2-3-7(5-10)8(9)6-11/h2-4H,1H3 |
InChIKey | LBGYNJWABFQQIN-UHFFFAOYSA-N |
Mol Weight | 158.16 g/mol |
Molecular Formula | C9H6N2O |
Exact Mass | 158.048013 g/mol |
SpectraBase Spectrum ID | DsgjxEvlG5f |
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Name | 3-methoxybenzene-1,2-dicarbonitrile |
Comments | Less than 3 mono-isotopic peaks |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C9H6N2O |
InChI | InChI=1S/C9H6N2O/c1-12-9-4-2-3-7(5-10)8(9)6-11/h2-4H,1H3 |
InChIKey | LBGYNJWABFQQIN-UHFFFAOYSA-N |
Molecular Weight | 158.160 g/mol |
SMILES | C(c1c(C#N)c(ccc1)OC)#N |
SPLASH | splash10-0a4i-0900000000-128ddd9df81d8b1616a5 |
Source of Spectrum | F2-41-1797-27 |
Wiley ID | 1599590 |