New Database Available - Released on 23/03/2024.
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molecules
Showing 91 to 120 of 771 results
 
Name
CAS
Mixture
CID
InChIKey
Smiles
(R/S)-Limonene, sum of isomers sum of isomers 22311 XMGQYMWWDOXHJM-UHFFFAOYSA-N CC1=CCC(CC1)C(=C)C
(-)-limonene 5989-54-8 mono 439250 XMGQYMWWDOXHJM-SNVBAGLBSA-N CC1=CC[C@H](CC1)C(=C)C
(R)-Limonene mono 440917 XMGQYMWWDOXHJM-JTQLQIEISA-N CC1=CC[C@@H](CC1)C(=C)C
Hydroxyacetone mono 8299 XLSMFKSTNGKWQX-UHFFFAOYSA-N CC(=O)CO
cis-6-nonen-1-ol mono 5362792 XJHRZBIBSSVCEL-ARJAWSKDSA-N CC/C=C\CCCCCO
heliotropyl acetone mono 6040503 XIYPXOFSURQTTJ-NSCUHMNNSA-N CC(=O)/C=C/C1=CC2=C(C=C1)OCO2
ethyl hexadecanoate 628-97-7 mono 12366 XIRNKXNNONJFQO-UHFFFAOYSA-N CCCCCCCCCCCCCCCC(=O)OCC
Homocamfin sum of isomers 222994 XHJJEWBMBSQVCJ-UHFFFAOYSA-N CC1=CC(=O)CC(C1)C(C)C
2-Methylbutyl acetate sum of isomers 12209 XHIUFYZDQBSEMF-UHFFFAOYSA-N CCC(C)COC(=O)C
19-OH AD 510-64-5 mono 252379 XGUHPTGEXRHMQQ-BGJMDTOESA-N C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4= ...
Ethyl acetate mono 8857 XEKOWRVHYACXOJ-UHFFFAOYSA-N CCOC(=O)C
Isoamyl allylglycolate 67634-00-8 mono 106729 XCWPXUNHSPOFGV-UHFFFAOYSA-N CC(C)CCOCC(=O)OCC=C
propionic acid 79-09-4 mono 1032 XBDQKXXYIPTUBI-UHFFFAOYSA-N CCC(=O)O
hexyl butyrate 2639-63-6 mono 17525 XAPCMTMQBXLDBB-UHFFFAOYSA-N CCCCCCOC(=O)CCC
Tetrahydrofuran mono 8028 WYURNTSHIVDZCO-UHFFFAOYSA-N C1CCOC1
7-octen-1-ol mono 83203 WXPWPYISTQCNDP-UHFFFAOYSA-N C=CCCCCCCO
musk ketone mono 6669 WXCMHFPAUCOJIG-UHFFFAOYSA-N CC1=C(C(=C(C(=C1[N+](=O)[O-])C(C)(C)C)[N ...
octanoic acid 124-07-2 mono 379 WWZKQHOCKIZLMA-UHFFFAOYSA-N CCCCCCCC(=O)O
2,2,5,5-tetramethyl-4-propan-2-yl-1,3-dioxane sum of isomers 112457 WVYKHQRCBWWGFK-UHFFFAOYSA-N CC(C)C1C(COC(O1)(C)C)(C)C
Benzyl alcohol mono 244 WVDDGKGOMKODPV-UHFFFAOYSA-N C1=CC=C(C=C1)CO
terpineol 98-55-5 sum of isomers 17100 WUOACPNHFRMFPN-UHFFFAOYSA-N CC1=CCC(CC1)C(C)(C)O
2-[(1S)-4-methylcyclohex-3-en-1-yl]propan-2-ol 10482-56-1 mono 443162 WUOACPNHFRMFPN-SECBINFHSA-N CC1=CC[C@H](CC1)C(C)(C)O
cuminaldehyde mono 326 WTWBUQJHJGUZCY-UHFFFAOYSA-N CC(C)C1=CC=C(C=C1)C=O
Nootkatone 4674-50-4 mono 1268142 WTOYNNBCKUYIKC-JMSVASOKSA-N C[C@@H]1CC(=O)C=C2[C@]1(C[C@@H](CC2)C(=C ...
3,7-Dimethyl-2,6-octadienal sum of isomers 8843 WTEVQBCEXWBHNA-UHFFFAOYSA-N CC(=CCCC(=CC=O)C)C
citral 5392-40-5 mono 638011 WTEVQBCEXWBHNA-JXMROGBWSA-N CC(=CCC/C(=C/C=O)/C)C
beta-pinene 127-91-3 sum of isomers 14896 WTARULDDTDQWMU-UHFFFAOYSA-N CC1(C2CCC(=C)C1C2)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)-6,6-Dimethyl-2-methylenebicyclo[3.1.1]heptane 18172-67-3 mono 440967 WTARULDDTDQWMU-IUCAKERBSA-N CC1([C@H]2CCC(=C)[C@@H]1C2)C
undecavertol 81782-77-6 mono 6441135 WSTQLNQRVZNEDV-CSKARUKUSA-N CCCCCC(/C(=C/CC)/C)O