New Database Available - Released on 29/09/2026.
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molecules
Showing 511 to 540 of 763 results
 
Name
Mixture
Reference
Name
CAS
Mixture
CID
InChIKey
SMILES
Lanierone 28750-52-9 Monomolecular 642486 GKOBUKITZSFCJC-UHFFFAOYSA-N CC1=CC(C=C(C1=O)O)(C)C
Styrene 100-42-5 Monomolecular 7501 PPBRXRYQALVLMV-UHFFFAOYSA-N C=CC1=CC=CC=C1
Vuaa1 525582-84-7 Monomolecular 1319135 UWCCKVJVOHTHAF-UHFFFAOYSA-N CCC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CC)C3=C ...
Dimethyl Sulfoxide 67-68-5 Monomolecular 679 IAZDPXIOMUYVGZ-UHFFFAOYSA-N CS(=O)C
(Z)-2-Methyl-6-methylene-2,7-octadien-1-ol 17015-29-1 Monomolecular 5319723 IEVYLQISZQFFGA-JXMROGBWSA-N C/C(=C\CCC(=C)C=C)/CO
4-Phenyl-2-butanol 2344-70-9 Sum of Isomers 61302 GDWRKZLROIFUML-UHFFFAOYSA-N CC(CCC1=CC=CC=C1)O
Menthol 1490-04-6 Sum of Isomers 1254 NOOLISFMXDJSKH-UHFFFAOYSA-N CC1CCC(C(C1)O)C(C)C
Bombykol 765-17-3 Monomolecular 445128 CIVIWCVVOFNUST-SCFJQAPRSA-N CCC/C=C\C=C\CCCCCCCCCO
3-Hexen-1-ol 544-12-7 Sum of Isomers 10993 UFLHIIWVXFIJGU-UHFFFAOYSA-N CCC=CCCO
1,5-Hexadien-3-ol 924-41-4 Sum of Isomers 79122 SZYLTIUVWARXOO-UHFFFAOYSA-N C=CCC(C=C)O
3-Hexenyl acetate, (3E)-, cis-3-HEXENYL ACETATE 3681-82-1, 3681-71-8 Mixture 5352557 and 5363388 NPFVOOAXDOBMCE-SNAWJCMRSA-N, NPFVOOAXDOBMCE-PLNGDY ... CC/C=C/CCOC(=O)C, CC/C=C\CCOC(=O)C
Henkel100 N.A. Mixture Henkel100 N.A. N.A.
trans-Jasmone 6261-18-3 Monomolecular 1549019 XMLSXPIVAXONDL-SNAWJCMRSA-N CC/C=C/CC1=C(CCC1=O)C
Dihydrojasmone 1128-08-1 Monomolecular 62378 YCIXWYOBMVNGTB-UHFFFAOYSA-N CCCCCC1=C(CCC1=O)C
2-Cyclopenten-1-one, 2-pentyl- 25564-22-1 Monomolecular 117549 ILHZVKAXFCDFMT-UHFFFAOYSA-N CCCCCC1=CCCC1=O
2-Pentylcyclopentan-1-one 4819-67-4 Sum of Isomers 20959 VNWOJVJCRAHBJJ-UHFFFAOYSA-N CCCCCC1CCCC1=O
3-Methyl-2-cyclopenten-1-one 2758-18-1 Monomolecular 17691 CHCCBPDEADMNCI-UHFFFAOYSA-N CC1=CC(=O)CC1
Cyclopentanone 120-92-3 Monomolecular 8452 BGTOWKSIORTVQH-UHFFFAOYSA-N C1CCC(=O)C1
Methyl vaccenate 6198-58-9 Monomolecular 5364432 PVVODBCDJBGMJL-CMDGGOBGSA-N CCCCCC/C=C/CCCCCCCCCC(=O)OC
2,4-Dimethylthiazole 541-58-2 Monomolecular 10934 OBSLLHNATPQFMJ-UHFFFAOYSA-N CC1=CSC(=N1)C
4-Propylbenzaldehyde 28785-06-0 Monomolecular 120047 MAUCRURSQMOFGV-UHFFFAOYSA-N CCCC1=CC=C(C=C1)C=O
Butylamine 109-73-9 Monomolecular 8007 HQABUPZFAYXKJW-UHFFFAOYSA-N CCCCN
Oleic Acid 112-80-1 Monomolecular 445639 ZQPPMHVWECSIRJ-KTKRTIGZSA-N CCCCCCCC/C=C\CCCCCCCC(=O)O
Dimethyl Disulfide 624-92-0 Monomolecular 12232 WQOXQRCZOLPYPM-UHFFFAOYSA-N CSSC
Pentylamine 110-58-7 Monomolecular 8060 DPBLXKKOBLCELK-UHFFFAOYSA-N CCCCCN
Undecanoic Acid 112-37-8 Monomolecular 8180 ZDPHROOEEOARMN-UHFFFAOYSA-N CCCCCCCCCCC(=O)O
1-Octyn-3-ol 818-72-4 Sum of Isomers 13166 VUGRNZHKYVHZSN-UHFFFAOYSA-N CCCCCC(C#C)O
Methyl Palmitate 112-39-0 Monomolecular 8181 FLIACVVOZYBSBS-UHFFFAOYSA-N CCCCCCCCCCCCCCCC(=O)OC
Ethyl Oleate 111-62-6 Monomolecular 5363269 LVGKNOAMLMIIKO-QXMHVHEDSA-N CCCCCCCC/C=C\CCCCCCCC(=O)OCC
N,N-diethyl-m-toluamide 134-62-3 Monomolecular 4284 MMOXZBCLCQITDF-UHFFFAOYSA-N CCN(CC)C(=O)C1=CC=CC(=C1)C
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