New Database Available - Released on 23/03/2024.
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molecules
Showing 481 to 510 of 768 results
 
Name
CAS
Mixture
CID
InChIKey
Smiles
heptyl isobutyrate mono 61304 RFDUMBPGZUIKOG-UHFFFAOYSA-N CCCCCCCOC(=O)C(C)C
Alpha-Hexylcinnamaldehyde mono 1550884 GUUHFMWKWLOQMM-NTCAYCPXSA-N CCCCCC/C(=C\C1=CC=CC=C1)/C=O
isobornyl acetate mono 637531 KGEKLUUHTZCSIP-FOGDFJRCSA-N CC(=O)O[C@@H]1C[C@H]2CC[C@@]1(C2(C)C)C
p-tolyl isobutyrate mono 7685 UPPSFGGDKACIKP-UHFFFAOYSA-N CC1=CC=C(C=C1)OC(=O)C(C)C
o-tolyl isobutyrate mono 61954 FDJBDZVTTXWIQM-UHFFFAOYSA-N CC1=CC=CC=C1OC(=O)C(C)C
p-tolyl phenylacetate mono 60997 OJEQSSJFSNLMLB-UHFFFAOYSA-N CC1=CC=C(C=C1)OC(=O)CC2=CC=CC=C2
2-methoxy-3-methyl-pyrazine mono 17898 VKJIAEQRKBQLLA-UHFFFAOYSA-N CC1=NC=CN=C1OC
prenyl acetate mono 14489 XXIKYCPRDXIMQM-UHFFFAOYSA-N CC(=CCOC(=O)C)C
triethylamine mono 8471 ZMANZCXQSJIPKH-UHFFFAOYSA-N CCN(CC)CC
butyraldehyde mono 261 ZTQSAGDEMFDKMZ-UHFFFAOYSA-N CCCC=O
azelaic acid dichloride mono 67165 HGEVGSTXQGZPCL-UHFFFAOYSA-N C(CCCC(=O)Cl)CCCC(=O)Cl
vanillic acid mono 8468 WKOLLVMJNQIZCI-UHFFFAOYSA-N COC1=C(C=CC(=C1)C(=O)O)O
2-ethylphenol mono 6997 IXQGCWUGDFDQMF-UHFFFAOYSA-N CCC1=CC=CC=C1O
2-Coumaranone mono 68382 ACZGCWSMSTYWDQ-UHFFFAOYSA-N C1C2=CC=CC=C2OC1=O
4-Chromanone mono 68110 MSTDXOZUKAQDRL-UHFFFAOYSA-N C1COC2=CC=CC=C2C1=O
Piperonyl alcohol mono 10322 BHUIUXNAPJIDOG-UHFFFAOYSA-N C1OC2=C(O1)C=C(C=C2)CO
4-Hydroxycoumarin mono 54682930 VXIXUWQIVKSKSA-UHFFFAOYSA-N C1=CC=C2C(=C1)C(=CC(=O)O2)O
(+)-Dihydrocarvone sum of isomers 24473 AZOCECCLWFDTAP-UHFFFAOYSA-N CC1CCC(CC1=O)C(=C)C
2,3-Hexanedione mono 19707 MWVFCEVNXHTDNF-UHFFFAOYSA-N CCCC(=O)C(=O)C
3-Heptanone mono 7802 NGAZZOYFWWSOGK-UHFFFAOYSA-N CCCCC(=O)CC
3,4-Hexanedione mono 62539 KVFQMAZOBTXCAZ-UHFFFAOYSA-N CCC(=O)C(=O)CC
Allyl benzene mono 9309 HJWLCRVIBGQPNF-UHFFFAOYSA-N C=CCC1=CC=CC=C1
Butyl butyryllactate sum of isomers 24114 NORZZKKLCYMBBF-UHFFFAOYSA-N CCCCOC(=O)C(C)OC(=O)CCC
Butyl formate mono 11614 NMJJFJNHVMGPGM-UHFFFAOYSA-N CCCCOC=O
Nonanethiol mono 15077 ZVEZMVFBMOOHAT-UHFFFAOYSA-N CCCCCCCCCS
Phenyl acetate mono 31229 IPBVNPXQWQGGJP-UHFFFAOYSA-N CC(=O)OC1=CC=CC=C1
2-decenal sum of isomers 19801 MMFCJPPRCYDLLZ-UHFFFAOYSA-N CCCCCCCC=CC=O
isobornyl acetate sum of isomers 6448 KGEKLUUHTZCSIP-UHFFFAOYSA-N CC(=O)OC1CC2CCC1(C2(C)C)C
r-limonene sum of isomers 91691547 JRFITZGBELIFQM-UHFFFAOYSA-N CC(=C)C1CCC2(OC(C1)OO2)C
3-methyl-valeric acid sum of isomers 7755 IGIDLTISMCAULB-UHFFFAOYSA-N CCC(C)CC(=O)O