New Database Available - Released on 29/09/2026.
banner
molecules
Showing 691 to 720 of 763 results
 
Name
Mixture
Reference
Name
CAS
Mixture
CID
InChIKey
SMILES
Cresatin 122-46-3 Monomolecular 67406 OTGAHJPFNKQGAE-UHFFFAOYSA-N CC1=CC(=CC=C1)OC(=O)C
2-Octanol 123-96-6 Sum of Isomers 20083 SJWFXCIHNDVPSH-UHFFFAOYSA-N CCCCCCC(C)O
Thujone, beta-Thujone 546-80-5, 471-15-8 Mixture 261491 + 91456 USMNOWBWPHYOEA-MRTMQBJTSA-N, USMNOWBWPHYOEA-XKSSXD ... C[C@@H]1[C@H]2C[C@]2(CC1=O)C(C)C, C[C@H] ...
Triethylamine 121-44-8 Monomolecular 8471 ZMANZCXQSJIPKH-UHFFFAOYSA-N CCN(CC)CC
Naphthalene 91-20-3 Monomolecular 931 UFWIBTONFRDIAS-UHFFFAOYSA-N C1=CC=C2C=CC=CC2=C1
1,5-Octadien-3-ol 83861-74-9 Sum of Isomers 205986 APFBWMGEGSELQP-UHFFFAOYSA-N CCC=CCC(C=C)O
Citral, Neral 5392-40-5, 106-26-3 Mixture 638011 + 643779 WTEVQBCEXWBHNA-JXMROGBWSA-N, WTEVQBCEXWBHNA-YFHOEE ... CC(=CCC/C(=C/C=O)/C)C, CC(=CCC/C(=C\C=O) ...
Furaneol 3658-77-3 Sum of Isomers 19309 INAXVXBDKKUCGI-UHFFFAOYSA-N CC1C(=O)C(=C(O1)C)O
2,5-dimethyl-4-methoxy-3(2H)-furanone 4077-47-8 Sum of Isomers 61325 SIMKGHMLPVDSJE-UHFFFAOYSA-N CC1C(=O)C(=C(O1)C)OC
1-Iodohexadecane 544-77-4 Monomolecular 11007 KMWHQYDMBYABKL-UHFFFAOYSA-N CCCCCCCCCCCCCCCCI
Theophylline 58-55-9 Monomolecular 2153 ZFXYFBGIUFBOJW-UHFFFAOYSA-N CN1C2=C(C(=O)N(C1=O)C)NC=N2
Phenyl-1-naphthylamine 90-30-2 Monomolecular 7013 XQVWYOYUZDUNRW-UHFFFAOYSA-N C1=CC=C(C=C1)NC2=CC=CC3=CC=CC=C32
Thiazolidinedione 2295-31-0 Monomolecular 5437 ZOBPZXTWZATXDG-UHFFFAOYSA-N C1C(=O)NC(=O)S1
D-Camphor 464-49-3 Monomolecular 159055 DSSYKIVIOFKYAU-XCBNKYQSSA-N C[C@@]12CC[C@@H](C1(C)C)CC2=O
Camphor, (-)- 464-48-2 Monomolecular 444294 DSSYKIVIOFKYAU-OIBJUYFYSA-N C[C@]12CC[C@H](C1(C)C)CC2=O
Icaridin 119515-38-7 Sum of Isomers 125098 QLHULAHOXSSASE-UHFFFAOYSA-N CCC(C)OC(=O)N1CCCCC1CCO
Ethyl butylacetylaminopropionate 52304-36-6 Monomolecular 104150 VZRKEAFHFMSHCD-UHFFFAOYSA-N CCCCN(CCC(=O)OCC)C(=O)C
Ethyl 2-aminobenzoate 87-25-2 Monomolecular 6877 TWLLPUMZVVGILS-UHFFFAOYSA-N CCOC(=O)C1=CC=CC=C1N
Butyl anthranilate 7756-96-9 Monomolecular 24433 HUIYGGQINIVDNW-UHFFFAOYSA-N CCCCOC(=O)C1=CC=CC=C1N
Methyl N,N-dimethylanthranilate 10072-05-6 Monomolecular 82336 ZCNSBHAIPOWHJE-UHFFFAOYSA-N CN(C)C1=CC=CC=C1C(=O)OC
Jasmonic Acid 6894-38-8 Monomolecular 5281166 ZNJFBWYDHIGLCU-HWKXXFMVSA-N CC/C=C\C[C@@H]1[C@H](CCC1=O)CC(=O)O
L-Citronellol 7540-51-4 Monomolecular 7793 QMVPMAAFGQKVCJ-JTQLQIEISA-N C[C@@H](CCC=C(C)C)CCO
cis-11-Octadecenoic acid methyl ester 1937-63-9 Monomolecular 5364505 PVVODBCDJBGMJL-HJWRWDBZSA-N CCCCCC/C=C\CCCCCCCCCC(=O)OC
Ethyl acrylate 140-88-5 Monomolecular 8821 JIGUQPWFLRLWPJ-UHFFFAOYSA-N CCOC(=O)C=C
Methyl palmitoleate 1120-25-8 Monomolecular 643801 IZFGRAGOVZCUFB-HJWRWDBZSA-N CCCCCC/C=C\CCCCCCCC(=O)OC
β-Farnesene 18794-84-8 Monomolecular 5281517 JSNRRGGBADWTMC-NTCAYCPXSA-N CC(=CCC/C(=C/CCC(=C)C=C)/C)C
Pyrethrin I 121-21-1 Monomolecular 5281045 ROVGZAWFACYCSP-VUMXUWRFSA-N CC1=C(C(=O)C[C@@H]1OC(=O)[C@@H]2[C@H](C2 ...
Pyrethrin II 121-29-9 Monomolecular 5281555 VJFUPGQZSXIULQ-XIGJTORUSA-N CC1=C(C(=O)C[C@@H]1OC(=O)[C@@H]2[C@H](C2 ...
Cinerin I 25402-06-6 Monomolecular 5281547 FMTFEIJHMMQUJI-DFKXKMKHSA-N C/C=C\CC1=C([C@H](CC1=O)OC(=O)[C@@H]2[C@ ...
cinerin II 121-20-0 Monomolecular 5281548 SHCRDCOTRILILT-WOBDGSLYSA-N C/C=C\CC1=C([C@H](CC1=O)OC(=O)[C@@H]2[C@ ...
Filters
Molecule
Name
Mixture
Resources
Reference