New Database Available - Released on 23/03/2024.
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molecules
Showing 211 to 240 of 771 results
 
Name
CAS
Mixture
CID
InChIKey
Smiles
2-sulfanylpentan-3-one sum of isomers 529635 TWOGJUHCCNLYPC-UHFFFAOYSA-N CCC(=O)C(C)S
ethyl heptanoate mono 7797 TVQGDYNRXLTQAP-UHFFFAOYSA-N CCCCCCC(=O)OCC
Dodecanedioic acid mono 12736 TVIDDXQYHWJXFK-UHFFFAOYSA-N C(CCCCCC(=O)O)CCCCC(=O)O
tetradecanoic acid 544-63-8 mono 11005 TUNFSRHWOTWDNC-UHFFFAOYSA-N CCCCCCCCCCCCCC(=O)O
5-decanol sum of isomers 99868 SZMNDOUFZGODBR-UHFFFAOYSA-N CCCCCC(CCCC)O
(3R/3S)-3-Sulfanylpentan-2-one, sum of isomers sum of isomers 62237 SZECUQRKLXRGSJ-UHFFFAOYSA-N CCC(C(=O)C)S
cyclodecanone mono 73918 SXOZDDAFVJANJP-UHFFFAOYSA-N C1CCCCC(=O)CCCC1
calone mono 120101 SWUIQEBPZIHZQS-UHFFFAOYSA-N CC1=CC2=C(C=C1)OCC(=O)CO2
Musk ambrette mono 6753 SUAUILGSCPYJCS-UHFFFAOYSA-N CC1=C(C=C(C(=C1[N+](=O)[O-])OC)C(C)(C)C) ...
3-Octyl acetate sum of isomers 521238 STZUZYMKSMSTOU-UHFFFAOYSA-N CCCCCC(CC)OC(=O)C
trans-2-Dodecenal mono 5283361 SSNZFFBDIMUILS-ZHACJKMWSA-N CCCCCCCCC/C=C/C=O
2-Methyl-3-(methyldisulfanyl)furan mono 47649 SRUTWBWLFKSTIS-UHFFFAOYSA-N CC1=C(C=CO1)SSC
cyclopentadecane mono 67525 SRONXYPFSAKOGH-UHFFFAOYSA-N C1CCCCCCCCCCCCCC1
3-Phenyl-1-butanol 2722-36-3 sum of isomers 94243 SQGBBDFDRHDJCJ-UHFFFAOYSA-N CC(CCO)C1=CC=CC=C1
quinoline 91-22-5 mono 7047 SMWDFEZZVXVKRB-UHFFFAOYSA-N C1=CC=C2C(=C1)C=CC=N2
Furfuryl methyl sulfide mono 518937 SKSFHXVDHVKIBN-UHFFFAOYSA-N CSCC1=CC=CO1
d-tetradecalactone sum of isomers 520296 SKQYTJLYRIFFCO-UHFFFAOYSA-N CCCCCCCCCC1CCCC(=O)O1
allyl heptanoate mono 8878 SJWKGDGUQTWDRV-UHFFFAOYSA-N CCCCCCC(=O)OCC=C
2-octanol sum of isomers 20083 SJWFXCIHNDVPSH-UHFFFAOYSA-N CCCCCCC(C)O
(S)-(+)-2-octanol mono 2723888 SJWFXCIHNDVPSH-QMMMGPOBSA-N CCCCCC[C@H](C)O
(2R/2S)-4-methoxy-2,5-dimethylfuran-3(2H)-one sum of isomers 61325 SIMKGHMLPVDSJE-UHFFFAOYSA-N CC1C(=O)C(=C(O1)C)OC
indol mono 798 SIKJAQJRHWYJAI-UHFFFAOYSA-N C1=CC=C2C(=C1)C=CN2
Ethyl hexanoate mono 31265 SHZIWNPUGXLXDT-UHFFFAOYSA-N CCCCCC(=O)OCC
13-cis-Retinoic acid 4759-48-2 mono 5282379 SHGAZHPCJJPHSC-XFYACQKRSA-N CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C\C(= ...
jasmorange sum of isomers 95594 SGVBCLGVIOFAFT-UHFFFAOYSA-N CC1=CC=C(C=C1)CC(C)C=O
lilial 80-54-6 sum of isomers 228987 SDQFDHOLCGWZPU-UHFFFAOYSA-N CC(CC1=CC=C(C=C1)C(C)(C)C)C=O
eugenol acetate 93-28-7 mono 7136 SCCDQYPEOIRVGX-UHFFFAOYSA-N CC(=O)OC1=C(C=C(C=C1)CC=C)OC
piperonal mono 8438 SATCULPHIDQDRE-UHFFFAOYSA-N C1OC2=C(O1)C=C(C=C2)C=O
Hypo-lem sum of isomers 170284 SAPMLSXAXRULJB-UHFFFAOYSA-N CC(C)CCCC(C)CC#N
delta-tridecalactone sum of isomers 110977 RZZLMGATMUAJPX-UHFFFAOYSA-N CCCCCCCCC1CCCC(=O)O1