New Database Available - Released on 23/03/2024.
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molecules
Showing 361 to 390 of 768 results
 
Name
CAS
Mixture
CID
InChIKey
Smiles
α-Phellandrene sum of isomers 7460 OGLDWXZKYODSOB-UHFFFAOYSA-N CC1=CCC(C=C1)C(C)C
2,2-dimethyl-3(2H)-furanone mono 147604 HVNICCSXGONRCB-UHFFFAOYSA-N CC1(C(=O)C=CO1)C
3-methyl-2(5H)-furanone mono 30945 VGHBEMPMIVEGJP-UHFFFAOYSA-N CC1=CCOC1=O
2,5-dimethylfuran-3-one sum of isomers 85730 ASOSVCXGWPDUGN-UHFFFAOYSA-N CC1C(=O)C=C(O1)C
2-methyl-3-sulfanylpropan-1-ol sum of isomers 529079 FCIVYWQHILCTLI-UHFFFAOYSA-N CC(CO)CS
2-Methyl-3-sulfanylheptan-1-ol sum of isomers 21997288 OCZSUTGSYBERRF-UHFFFAOYSA-N CCCCC(C(C)CO)S
2-methyl-3-sulfanylbutan-1-ol sum of isomers 6430892 RFMHFOPFUZZBAD-UHFFFAOYSA-N CC(CO)C(C)S
2-methyl-3-sulfanylhexan-1-ol sum of isomers 21997287 XVFIAOJQUHTZSV-UHFFFAOYSA-N CCCC(C(C)CO)S
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
(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
(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
(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
Sabinene 2009-00-9 sum of isomers 18818 NDVASEGYNIMXJL-UHFFFAOYSA-N CC(C)C12CCC(=C)C1C2
1-(2,6,6-Trimethylcyclohexa-1,3-dien-1-yl)-2-buten-1-one 23696-85-7 sum of isomers 62775 POIARNZEYGURDG-UHFFFAOYSA-N CC=CC(=O)C1=C(C=CCC1(C)C)C
4-Ethyl-2-methoxyphenol 2785-89-9 mono 62465 CHWNEIVBYREQRF-UHFFFAOYSA-N CCC1=CC(=C(C=C1)O)OC
4-Methyl-4-sulfanylpentan-2-one 19872-52-7 mono 88290 QRNZMFDCKKEPSX-UHFFFAOYSA-N CC(=O)CC(C)(C)S
(E,Z)-2,4-Nonadienal 21661-99-4 mono 6429282 ZHHYXNZJDGDGPJ-IGTJQSIKSA-N CCCC/C=C\C=C\C=O
Ethanal 75-07-0 mono 177 IKHGUXGNUITLKF-UHFFFAOYSA-N CC=O
Methyl 2-methylbutanoate 868-57-5 sum of isomers 13357 OCWLYWIFNDCWRZ-UHFFFAOYSA-N CCC(C)C(=O)OC
2-Methylpropan-1-ol 78-83-1 mono 6560 ZXEKIIBDNHEJCQ-UHFFFAOYSA-N CC(C)CO
(E)-3-(4-Hydroxyphenyl)prop-2-enoic acid 501-98-4 mono 637542 NGSWKAQJJWESNS-ZZXKWVIFSA-N C1=CC(=CC=C1/C=C/C(=O)O)O
2-Phenylacetic acid 103-82-2 mono 999 WLJVXDMOQOGPHL-UHFFFAOYSA-N C1=CC=C(C=C1)CC(=O)O
6-Pentyloxan-2-one 705-86-2 sum of isomers 12810 GHBSPIPJMLAMEP-UHFFFAOYSA-N CCCCCC1CCCC(=O)O1
1-(2-Aminophenyl)ethanone 551-93-9 mono 11086 GTDQGKWDWVUKTI-UHFFFAOYSA-N CC(=O)C1=CC=CC=C1N
cyclopentadecanone mono 10409 OSOIQJGOYGSIMF-UHFFFAOYSA-N C1CCCCCCCC(=O)CCCCCC1
5-Cyclohexadecen-1-one mono 162268 ABRIMXGLNHCLIP-UHFFFAOYSA-N C1CCCCCC(=O)CCCC=CCCCC1
3-methylcyclopentadec-5-en-1-one sum of isomers 54116156 NKMKFQCVDZVEJR-UHFFFAOYSA-N CC1CC=CCCCCCCCCCC(=O)C1
(8E)-cyclohexadec-8-en-1-one mono 6365152 ZGEHHVDYDNXYMW-OWOJBTEDSA-N C1CCC/C=C/CCCCCCC(=O)CCC1
(E)-3-Methylcyclotetradeca-5-ene-1-one 259854-70-1 mono 66823518 ZFGBKXBPHOUSJX-VQHVLOKHSA-N CC1C/C=C/CCCCCCCCC(=O)C1