New Database Available - Released on 23/03/2024.
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molecules
Showing 751 to 768 of 768 results
 
Name
CAS
Mixture
CID
InChIKey
Smiles
Allyl benzene mono 9309 HJWLCRVIBGQPNF-UHFFFAOYSA-N C=CCC1=CC=CC=C1
Empetal sum of isomers 93199 MQBIZQLCHSZBOI-UHFFFAOYSA-N CC(=CCCC1=CCC(CC1)C=O)C
3-Phenyl-1-butanol 2722-36-3 sum of isomers 94243 SQGBBDFDRHDJCJ-UHFFFAOYSA-N CC(CCO)C1=CC=CC=C1
Piperonyl acetate mono 9473 PFWYHTORQZAGCA-UHFFFAOYSA-N CC(=O)OCC1=CC2=C(C=C1)OCO2
3-methylhexanoic acid sum of isomers 95315 NZQMQVJXSRMTCJ-UHFFFAOYSA-N CCCC(C)CC(=O)O
2-Methyl-3-phenylpropanal sum of isomers 95593 HEPHYCJJLAUKSB-UHFFFAOYSA-N CC(CC1=CC=CC=C1)C=O
jasmorange sum of isomers 95594 SGVBCLGVIOFAFT-UHFFFAOYSA-N CC1=CC=C(C=C1)CC(C)C=O
1-octanol 111-87-5 mono 957 KBPLFHHGFOOTCA-UHFFFAOYSA-N CCCCCCCCO
Diethyl sulfide mono 9609 LJSQFQKUNVCTIA-UHFFFAOYSA-N CCSCC
Hydroxypyruvic acid 1113-60-6 mono 964 HHDDCCUIIUWNGJ-UHFFFAOYSA-N C(C(=O)C(=O)O)O
Methyl tuberate sum of isomers 97707 LOQFOBUZYRBURV-UHFFFAOYSA-N CCCCCC1C(CC(=O)O1)C
(5E)-3-methylcyclopentadec-5-en-1-one mono 9834606 NKMKFQCVDZVEJR-CSKARUKUSA-N CC1C/C=C/CCCCCCCCCC(=O)C1
palmitic acid 57-10-3 mono 985 IPCSVZSSVZVIGE-UHFFFAOYSA-N CCCCCCCCCCCCCCCC(=O)O
Sulcatone mono 9862 UHEPJGULSIKKTP-UHFFFAOYSA-N CC(=CCCC(=O)C)C
19-Nortestosterone 434-22-0 mono 9904 NPAGDVCDWIYMMC-IZPLOLCNSA-N C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)C ...
phenyl acetaldehyde 122-78-1 mono 998 DTUQWGWMVIHBKE-UHFFFAOYSA-N C1=CC=C(C=C1)CC=O
5-decanol sum of isomers 99868 SZMNDOUFZGODBR-UHFFFAOYSA-N CCCCCC(CCCC)O
2-Phenylacetic acid 103-82-2 mono 999 WLJVXDMOQOGPHL-UHFFFAOYSA-N C1=CC=C(C=C1)CC(=O)O