New Database Available - Released on 29/09/2026.
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molecules
Showing 211 to 240 of 763 results
 
Name
Mixture
Reference
Name
CAS
Mixture
CID
InChIKey
SMILES
N,N-Dibutylformamide 761-65-9 Monomolecular 12975 NZMAJUHVSZBJHL-UHFFFAOYSA-N CCCCN(CCCC)C=O
Dihydroactinidiolide 17092-92-1 Monomolecular 6432173 IMKHDCBNRDRUEB-LLVKDONJSA-N C[C@@]12CCCC(C1=CC(=O)O2)(C)C
Dodecanal 112-54-9 Monomolecular 8194 HFJRKMMYBMWEAD-UHFFFAOYSA-N CCCCCCCCCCCC=O
Dodecane 112-40-3 Monomolecular 8182 SNRUBQQJIBEYMU-UHFFFAOYSA-N CCCCCCCCCCCC
Ethyl Dodecanoate 106-33-2 Monomolecular 7800 MMXKVMNBHPAILY-UHFFFAOYSA-N CCCCCCCCCCCC(=O)OCC
4-Ethylbenzaldehyde 4748-78-1 Monomolecular 20861 QNGNSVIICDLXHT-UHFFFAOYSA-N CCC1=CC=C(C=C1)C=O
Ethyl Myristate 124-06-1 Monomolecular 31283 MMKRHZKQPFCLLS-UHFFFAOYSA-N CCCCCCCCCCCCCC(=O)OCC
Ethyl palmitate 628-97-7 Monomolecular 12366 XIRNKXNNONJFQO-UHFFFAOYSA-N CCCCCCCCCCCCCCCC(=O)OCC
Eugenol 97-53-0 Monomolecular 3314 RRAFCDWBNXTKKO-UHFFFAOYSA-N COC1=C(C=CC(=C1)CC=C)O
Farnesene 502-61-4 Monomolecular 5281516 CXENHBSYCFFKJS-VDQVFBMKSA-N CC(=CCC/C(=C/C/C=C(\C)/C=C)/C)C
Geranylacetone 3796-70-1 Monomolecular 1549778 HNZUNIKWNYHEJJ-FMIVXFBMSA-N CC(=CCC/C(=C/CCC(=O)C)/C)C
Globulol 489-41-8 Monomolecular 12304985 AYXPYQRXGNDJFU-QTPLKFIXSA-N C[C@@H]1CC[C@@H]2[C@@H]1[C@H]3[C@H](C3(C ...
Glycerol 56-81-5 Monomolecular 753 PEDCQBHIVMGVHV-UHFFFAOYSA-N C(C(CO)O)O
Guaiacol 90-05-1 Monomolecular 460 LHGVFZTZFXWLCP-UHFFFAOYSA-N COC1=CC=CC=C1O
Heptacosane 593-49-7 Monomolecular 11636 BJQWYEJQWHSSCJ-UHFFFAOYSA-N CCCCCCCCCCCCCCCCCCCCCCCCCCC
Hexacosane 630-01-3 Monomolecular 12407 HMSWAIKSFDFLKN-UHFFFAOYSA-N CCCCCCCCCCCCCCCCCCCCCCCCCC
Homosalate 118-56-9 Sum of Isomers 8362 WSSJONWNBBTCMG-UHFFFAOYSA-N CC1CC(CC(C1)(C)C)OC(=O)C2=CC=CC=C2O
Humulene 6753-98-6 Monomolecular 5281520 FAMPSKZZVDUYOS-HRGUGZIWSA-N C/C/1=C\CC(/C=C/C/C(=C/CC1)/C)(C)C
Isoborneol 124-76-5 Monomolecular 6321405 DTGKSKDOIYIVQL-MRTMQBJTSA-N C[C@@]12CC[C@@H](C1(C)C)C[C@H]2O
Isophorone 78-59-1 Monomolecular 6544 HJOVHMDZYOCNQW-UHFFFAOYSA-N CC1=CC(=O)CC(C1)(C)C
Isophthalaldehyde 626-19-7 Monomolecular 34777 IZALUMVGBVKPJD-UHFFFAOYSA-N C1=CC(=CC(=C1)C=O)C=O
3-Methyl-3-buten-1-ol 763-32-6 Monomolecular 12988 CPJRRXSHAYUTGL-UHFFFAOYSA-N CC(=C)CCO
1-Methyl-4-Prop-1-En-2-Ylcyclohexene 138-86-3 Sum of Isomers 22311 XMGQYMWWDOXHJM-UHFFFAOYSA-N CC1=CCC(CC1)C(=C)C
Alpha-Terpineol 98-55-5 Sum of Isomers 17100 WUOACPNHFRMFPN-UHFFFAOYSA-N CC1=CCC(CC1)C(C)(C)O
M-Cymene 535-77-3 Monomolecular 10812 XCYJPXQACVEIOS-UHFFFAOYSA-N CC1=CC(=CC=C1)C(C)C
Methyl hexanoate 106-70-7 Monomolecular 7824 NUKZAGXMHTUAFE-UHFFFAOYSA-N CCCCCC(=O)OC
Methyl Oleate 112-62-9 Monomolecular 5364509 QYDYPVFESGNLHU-KHPPLWFESA-N CCCCCCCC/C=C\CCCCCCCC(=O)OC
Methyl Stearate 112-61-8 Monomolecular 8201 HPEUJPJOZXNMSJ-UHFFFAOYSA-N CCCCCCCCCCCCCCCCCC(=O)OC
Methyl 2,4-Dihydroxybenzoate 2150-47-2 Monomolecular 16523 IIFCLXHRIYTHPV-UHFFFAOYSA-N COC(=O)C1=C(C=C(C=C1)O)O
3-Methoxytoluene 100-84-5 Monomolecular 7530 OSIGJGFTADMDOB-UHFFFAOYSA-N CC1=CC(=CC=C1)OC
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