New Database Available - Released on 23/03/2024.
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molecules
Showing 151 to 180 of 768 results
 
Name
CAS
Mixture
CID
InChIKey
Smiles
Thiophen-2-ylmethanethiol mono 80408 GCZQHDFWKVMZOE-UHFFFAOYSA-N C1=CSC(=C1)CS
trimethylamine mono 1146 GETQZCLCWQTVFV-UHFFFAOYSA-N CN(C)C
amber core 139504-68-0 sum of isomers 53836233 GFVWSUIPAJYAEG-UHFFFAOYSA-N CC(C)(C)C1CCCCC1OCCCCO
6-Pentyloxan-2-one 705-86-2 sum of isomers 12810 GHBSPIPJMLAMEP-UHFFFAOYSA-N CCCCCC1CCCC(=O)O1
Decanoic Acid 334-48-5 mono 2969 GHVNFZFCNZKVNT-UHFFFAOYSA-N CCCCCCCCCC(=O)O
1,4-dioxacyclohexadecane-5,16-dione mono 41270 GJJSUPSPZIZYPM-UHFFFAOYSA-N C1CCCCCC(=O)OCCOC(=O)CCCC1
3,7-dimethyl-6-octenoic acid sum of isomers 10402 GJWSUKYXUMVMGX-UHFFFAOYSA-N CC(CCC=C(C)C)CC(=O)O
2,4-Octanedione mono 84192 GJYXGIIWJFZCLN-UHFFFAOYSA-N CCCCC(=O)CC(=O)C
geraniol 106-24-1 mono 637566 GLZPCOQZEFWAFX-JXMROGBWSA-N CC(=CCC/C(=C/CO)/C)C
nerol 106-25-2 mono 643820 GLZPCOQZEFWAFX-YFHOEESVSA-N CC(=CCC/C(=C\CO)/C)C
4-Methylacetophenone mono 8500 GNKZMNRKLCTJAY-UHFFFAOYSA-N CC1=CC=C(C=C1)C(=O)C
Ethyl phenyl glycidate sum of isomers 8469 GOMAKLPNAAZVCJ-UHFFFAOYSA-N CCOC(=O)C1C(O1)C2=CC=CC=C2
2,4-dimethyl-4-phenyloxolane 82461-14-1 sum of isomers 113514 GPMLJOOQCIHFET-UHFFFAOYSA-N CC1CC(CO1)(C)C2=CC=CC=C2
4-Bromobutyric acid mono 75809 GRHQDJDRGZFIPO-UHFFFAOYSA-N C(CC(=O)O)CBr
S-methyl thiobutanoate mono 62444 GRLJIIJNZJVMGP-UHFFFAOYSA-N CCCC(=O)SC
(1S,5S)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene 7785-26-4 mono 440968 GRWFGVWFFZKLTI-IUCAKERBSA-N CC1=CC[C@H]2C[C@@H]1C2(C)C
(1R,5R)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene 7785-70-8 mono 82227 GRWFGVWFFZKLTI-RKDXNWHRSA-N CC1=CC[C@@H]2C[C@H]1C2(C)C
alpha-pinene 80-56-8 sum of isomers 6654 GRWFGVWFFZKLTI-UHFFFAOYSA-N CC1=CCC2CC1C2(C)C
3-Methyl-2,4-pentanedione mono 69949 GSOHKPVFCOWKPU-UHFFFAOYSA-N CC(C(=O)C)C(=O)C
1-(2-Aminophenyl)ethanone 551-93-9 mono 11086 GTDQGKWDWVUKTI-UHFFFAOYSA-N CC(=O)C1=CC=CC=C1N
2-bromo-octanoic acid sum of isomers 552003 GTGTXZRPJHDASG-UHFFFAOYSA-N CCCCCCC(C(=O)O)Br
3-phenyl propyl propionate 122-74-7 mono 61052 GTNCESCYZPMXCJ-UHFFFAOYSA-N CCC(=O)OCCCC1=CC=CC=C1
D-maltose 69-79-4 mono 6255 GUBGYTABKSRVRQ-QUYVBRFLSA-N C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C ...
2-Ethoxynaphthalene mono 7129 GUMOJENFFHZAFP-UHFFFAOYSA-N CCOC1=CC2=CC=CC=C2C=C1
Alpha-Hexylcinnamaldehyde mono 1550884 GUUHFMWKWLOQMM-NTCAYCPXSA-N CCCCCC/C(=C\C1=CC=CC=C1)/C=O
Isojasmone mono 6435841 GVONPEQEUQYVNH-SNAWJCMRSA-N CC/C=C/CC1=C(C(=O)CC1)C
Dimethyl anthranilate mono 6826 GVOWHGSUZUUUDR-UHFFFAOYSA-N CNC1=CC=CC=C1C(=O)OC
homofuraneol sum of isomers 33931 GWCRPYGYVRXVLI-UHFFFAOYSA-N CCC1C(=O)C(=C(O1)C)O
isovaleric acid 503-74-2 mono 10430 GWYFCOCPABKNJV-UHFFFAOYSA-N CC(C)CC(=O)O
(Z)-3-Hexenal mono 643941 GXANMBISFKBPEX-ARJAWSKDSA-N CC/C=C\CC=O