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Przykłady Notacji SMILES - MANHAZ

Przykłady Notacji SMILES - MANHAZ

Przykłady Notacji SMILES - MANHAZ

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HFC-227ea (heptafluoropropan) C(F)(F)(F)C(F)C(F)(F)F<br />

HFC-236ea (heksafluoropropan) C(F)(F)(F)C(F)C(F)F<br />

HFC-245ea (pentafluoropropan) C(F)(F)C(F)(F)CF<br />

ALDEHYDY:<br />

Formaldehyd C=O<br />

Acetaldehyd CC=O<br />

Propanal CCC=O<br />

Butanal CCCC=O<br />

2-Metylo-1-propanal CC(C)C=O<br />

Pentanal CCCCC=O<br />

3-Metylo-1-butanal CC(C)CC=O<br />

2,2-Dimetylo-1-propanal CC(C)(C)C=O<br />

Benzaldehyd c1ccccc1C=O<br />

Akroleina C=CC=O<br />

meta-Akroleina C=C(C)C=O<br />

trans-Krotonaldehyd CC=CC=O<br />

Trichloroacetaldehyd C(CL)(CL)(CL)C=O<br />

Trifluoroacetaldehyd C(F)(F)(F)C=O<br />

Chlorodifluoroacetaldehyd C(F)(F)(CL)C=O<br />

Chloroacetaldehyd C(CL)C=O<br />

Dichloroacetaldehyd C(CL)(CL)C=O<br />

Chlorek acetylu CC(=O)CL<br />

Glikolaldehyd OCC=O<br />

KETONY:<br />

Aceton CC(=O)C<br />

2-Butanon CC(=O)CC<br />

2-Pentanon CC(=O)CCC<br />

3-Pentanon CCC(=O)CC<br />

2-Heksanon CC(=O)CCCC<br />

3-Heksanon CCC(=O)CCC<br />

2-Heptanon CC(=O)CCCCC<br />

3,3-Dimetylo-2-butanon CC(=O)C(C)(C)C<br />

2,4-Dimetylo-3-pentanon CC(C)C(=O)C(C)C<br />

4-Metylo-2-pentanon CC(=O)CC(C)C<br />

2,6-Dimetylo-4-heptanon CC(C)CC(=O)CC(C)C<br />

Keton metylowinylowy C=CC(=O)C<br />

Keten C=C=O<br />

Metylo keten CC=C=O<br />

Etyloketen CCC=C=O<br />

Cyklobutanon C1C(=O)CC1<br />

Cyklopentanon C1C(=O)CCC1<br />

Cykloheksanon C1C(=O)CCCC1<br />

2,4-Pentanedion CC(=O)CC(=O)C<br />

2,5-Heksanedion CC(=O)CCC(=O)C<br />

Hydroksyaceton OCC(=O)C<br />

Metoksyaceton COCC(=O)C

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