New Database Available - Released on 23/03/2024.
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molecules
Showing 1 to 30 of 768 results
 
Name
CAS
Mixture
CID
InChIKey
Smiles
(+)-Camphene mono 92221 CRPUJAZIXJMDBK-DTWKUNHWSA-N CC1([C@@H]2CC[C@@H](C2)C1=C)C
(+)-camphor mono 159055 DSSYKIVIOFKYAU-XCBNKYQSSA-N C[C@@]12CC[C@@H](C1(C)C)CC2=O
(+)-carvone 6485-40-1 mono 16724 ULDHMXUKGWMISQ-VIFPVBQESA-N CC1=CC[C@@H](CC1=O)C(=C)C
(+)-Dihydrocarveol mono 89755 KRCZYMFUWVJCLI-GUBZILKMSA-N C[C@H]1CC[C@@H](C[C@@H]1O)C(=C)C
(+)-dihydrocarvone 5524-05-0 mono 22227 AZOCECCLWFDTAP-RKDXNWHRSA-N C[C@@H]1CC[C@H](CC1=O)C(=C)C
(+)-Dihydrocarvone sum of isomers 24473 AZOCECCLWFDTAP-UHFFFAOYSA-N CC1CCC(CC1=O)C(=C)C
(+)-fenchone mono 1201521 LHXDLQBQYFFVNW-XCBNKYQSSA-N C[C@]12CC[C@H](C1)C(C2=O)(C)C
(+)-Limonene oxide,mixture of cis and trans sum of isomers 91496 CCEFMUBVSUDRLG-UHFFFAOYSA-N CC(=C)C1CCC2(C(C1)O2)C
(+)-menthol 2216-51-5 mono 165675 NOOLISFMXDJSKH-AEJSXWLSSA-N C[C@H]1CC[C@@H]([C@H](C1)O)C(C)C
(+)-Menthone mono 443159 NFLGAXVYCFJBMK-DTWKUNHWSA-N C[C@H]1CC[C@@H](C(=O)C1)C(C)C
(+)-Perillaaldehyde mono 1548901 RUMOYJJNUMEFDD-JTQLQIEISA-N CC(=C)[C@@H]1CCC(=CC1)C=O
(+)-Sabinene mono 10887971 NDVASEGYNIMXJL-NXEZZACHSA-N CC(C)[C@]12CCC(=C)[C@H]1C2
(+/-)-citronellal sum of isomers 7794 NEHNMFOYXAPHSD-UHFFFAOYSA-N CC(CCC=C(C)C)CC=O
(+/-)-Muscone 541-91-3 sum of isomers 10947 ALHUZKCOMYUFRB-UHFFFAOYSA-N CC1CCCCCCCCCCCCC(=O)C1
(-)-Camphene mono 440966 CRPUJAZIXJMDBK-BDAKNGLRSA-N CC1([C@H]2CC[C@H](C2)C1=C)C
(-)-camphor mono 444294 DSSYKIVIOFKYAU-OIBJUYFYSA-N C[C@]12CC[C@H](C1(C)C)CC2=O
(-)-Carveol mono 2724032 BAVONGHXFVOKBV-YHMJZVADSA-N CC1=CC[C@H](CC1O)C(=C)C
(-)-cis-Whiskey lactone mono 11094871 WNVCMFHPRIBNCW-YUMQZZPRSA-N CCCC[C@H]1[C@H](CC(=O)O1)C
(-)-Dihydrocarveol mono 443163 KRCZYMFUWVJCLI-OPRDCNLKSA-N C[C@@H]1CC[C@H](C[C@H]1O)C(=C)C
(-)-Fenchone 7787-20-4 mono 82229 LHXDLQBQYFFVNW-OIBJUYFYSA-N C[C@@]12CC[C@@H](C1)C(C2=O)(C)C
(-)-limonene 5989-54-8 mono 439250 XMGQYMWWDOXHJM-SNVBAGLBSA-N CC1=CC[C@H](CC1)C(=C)C
(-)-limonene oxide mono 10953718 CCEFMUBVSUDRLG-IDKOKCKLSA-N CC(=C)[C@H]1CCC2(C(C1)O2)C
(-)-menthol 2216-51-5 mono 16666 NOOLISFMXDJSKH-KXUCPTDWSA-N C[C@@H]1CC[C@H]([C@@H](C1)O)C(C)C
(-)-Myrtenal mono 1201529 KMRMUZKLFIEVAO-IUCAKERBSA-N CC1([C@H]2CC=C([C@@H]1C2)C=O)C
(-)-Perillaaldehyde mono 2724159 RUMOYJJNUMEFDD-SNVBAGLBSA-N CC(=C)[C@H]1CCC(=CC1)C=O
(-)-rose oxide mono 7093102 CZCBTSFUTPZVKJ-ZJUUUORDSA-N C[C@@H]1CCO[C@H](C1)C=C(C)C
(-)carvyl acetate mono 11964245 YTHRBOFHFYZBRJ-JHJMLUEUSA-N CC1=CC[C@H](CC1OC(=O)C)C(=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
(1R,5R)-6,6-Dimethyl-2-methylenebicyclo[3.1.1]heptane 19902-08-0 mono 10290825 WTARULDDTDQWMU-RKDXNWHRSA-N CC1([C@@H]2CCC(=C)[C@H]1C2)C
(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