New Database Available - Released on 23/03/2024.
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molecules
Showing 31 to 60 of 768 results
 
Name
CAS
Mixture
CID
InChIKey
Smiles
(E)-3-Methylcyclotetradeca-5-ene-1-one 259854-70-1 mono 66823518 ZFGBKXBPHOUSJX-VQHVLOKHSA-N CC1C/C=C/CCCCCCCCC(=O)C1
Cosmone sum of isomers 54543965 ZFGBKXBPHOUSJX-UHFFFAOYSA-N CC1CC=CCCCCCCCCC(=O)C1
2-Furfurylthiol mono 7363 ZFFTZDQKIXPDAF-UHFFFAOYSA-N C1=COC(=C1)CS
Undecanoic acid mono 8180 ZDPHROOEEOARMN-UHFFFAOYSA-N CCCCCCCCCCC(=O)O
heptyl acetate 112-06-1 mono 8159 ZCZSIDMEHXZRLG-UHFFFAOYSA-N CCCCCCCOC(=O)C
benzyl salicylate mono 8363 ZCTQGTTXIYCGGC-UHFFFAOYSA-N C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2O
allyl phenylacetate 1797-74-6 mono 15717 ZCDYAMJXVAUTIM-UHFFFAOYSA-N C=CCOC(=O)CC1=CC=CC=C1
2-isobutyl-3-methoxypyridine mono 58531255 ZBYPSGBBPAPHDG-UHFFFAOYSA-N CC(C)CC1=C(C=CC=N1)OC
methyl tetradecanoate 124-10-7 mono 31284 ZAZKJZBWRNNLDS-UHFFFAOYSA-N CCCCCCCCCCCCCC(=O)OC
Jasmonyl mono 162000 ZALVGSSYVAPZDA-UHFFFAOYSA-N CCCCCCCCC(OC(=O)C)OC(=O)C
2-decanone mono 12741 ZAJNGDIORYACQU-UHFFFAOYSA-N CCCCCCCCC(=O)C
Arachidonic acid 506-32-1 mono 444899 YZXBAPSDXZZRGB-DOFZRALJSA-N CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O
delta-undecalactone sum of isomers 61204 YZRXRLLRSPQHDK-UHFFFAOYSA-N CCCCCCC1CCCC(=O)O1
5H-5-Methyl-6,7-dihydrocyclopenta-[b]pyrazine sum of isomers 32065 YZEFQPIMXZVPKP-UHFFFAOYSA-N CC1CCC2=NC=CN=C12
ethyl octanoate 106-32-1 mono 7799 YYZUSRORWSJGET-UHFFFAOYSA-N CCCCCCCC(=O)OCC
12-Bromo-dodecanoic acid mono 175468 YYKBWYBUCFHYPR-UHFFFAOYSA-N C(CCCCCC(=O)O)CCCCCBr
dimethyl ethyl phenyl carbinol mono 7632 YXVSKJDFNJFXAJ-UHFFFAOYSA-N CC(C)(CCC1=CC=CC=C1)O
1-(3,3-dimethylcyclohexyl)ethyl acetate sum of isomers 91339 YWVSYRJWCROMKO-UHFFFAOYSA-N CC(C1CCCC(C1)(C)C)OC(=O)C
Dimethyl trisulfide mono 19310 YWHLKYXPLRWGSE-UHFFFAOYSA-N CSSSC
tert-butylbenzene 98-06-6 mono 7366 YTZKOQUCBOVLHL-UHFFFAOYSA-N CC(C)(C)C1=CC=CC=C1
(-)carvyl acetate mono 11964245 YTHRBOFHFYZBRJ-JHJMLUEUSA-N CC1=CC[C@H](CC1OC(=O)C)C(=C)C
Ethyl 3-(methylsulfanyl)propanoate mono 61592 YSNWHRKJEKWJNY-UHFFFAOYSA-N CCOC(=O)CCSC
methyl decanoate 110-42-9 mono 8050 YRHYCMZPEVDGFQ-UHFFFAOYSA-N CCCCCCCCCC(=O)OC
butyl heptanoate mono 21596 YPQSPODHFDGVAC-UHFFFAOYSA-N CCCCCCC(=O)OCCCC
5-Methylindole mono 11978 YPKBCLZFIYBSHK-UHFFFAOYSA-N CC1=CC2=C(C=C1)NC=C2
4-Ethenyl-2-methoxyphenol mono 332 YOMSJEATGXXYPX-UHFFFAOYSA-N COC1=C(C=CC(=C1)C=C)O
Normetanephrine 97-31-4 sum of isomers 1237 YNYAYWLBAHXHLL-UHFFFAOYSA-N COC1=C(C=CC(=C1)C(CN)O)O
Methyl nicotinate mono 7151 YNBADRVTZLEFNH-UHFFFAOYSA-N COC(=O)C1=CN=CC=C1
Esters mixture YLYBTZIQSIBWLI-UHFFFAOYSA-N GJQIMXVRFNLM ... CCCCCCCCOC(=O)C CCCCCCCCCOC(=O)C CCCCCCC ...
octyl acetate 112-14-1 mono 8164 YLYBTZIQSIBWLI-UHFFFAOYSA-N CCCCCCCCOC(=O)C