SpectraBase Compound ID | 9FhoRBpPFol |
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InChI | InChI=1S/C29H52O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27-24-28(30-2)26-29(25-27)31-3/h24-26H,4-23H2,1-3H3 |
InChIKey | CGHRAXIZYRXFKL-UHFFFAOYSA-N |
Mol Weight | 432.7 g/mol |
Molecular Formula | C29H52O2 |
Exact Mass | 432.396731 g/mol |
SpectraBase Spectrum ID | D6Qa9LZ6oik |
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Name | 1-Heneicosyl-3,5-bis(methoxy)benzene |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 432.396730912 u |
Formula | C29H52O2 |
InChI | InChI=1S/C29H52O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27-24-28(30-2)26-29(25-27)31-3/h24-26H,4-23H2,1-3H3 |
InChIKey | CGHRAXIZYRXFKL-UHFFFAOYSA-N |
Molecular Weight | 432.733 g/mol |
SMILES | C=1(C=C(C=C(C1)OC)OC)CCCCCCCCCCCCCCCCCCCCC |