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
α-Phellandrene sum of isomers 7460 OGLDWXZKYODSOB-UHFFFAOYSA-N CC1=CCC(C=C1)C(C)C
Zinarine sum of isomers 17972404 FUNYLZYOEJSMTO-UHFFFAOYSA-N CC1CCC(C(C1)C)C2=CC=CC=N2
Z-7-Decenal mono 5362695 UZFFFFWQKMPLAC-ARJAWSKDSA-N CC/C=C\CCCCCC=O
Z-4-decenal mono 5362620 CWRKZMLUDFBPAO-SREVYHEPSA-N CCCCC/C=C\CCC=O
Whiskey lactone sum of isomers 62900 WNVCMFHPRIBNCW-UHFFFAOYSA-N CCCCC1C(CC(=O)O1)C
Violet nitrile mono 6437774 DSOXXQLCMAEPEZ-ODYTWBPASA-N CC/C=C\CC/C=C/C#N
Vernolide mono 5281508 ZGXVZQZFVYSUDU-ULYHCOEVSA-N CC(=C)C(=O)O[C@H]1C[C@]23[C@H](O2)CC/C(= ...
Velvione mono 5362736 ABRIMXGLNHCLIP-VURMDHGXSA-N C1CCCCCC(=O)CCC/C=C\CCCC1
vanillin 121-33-5 mono 1183 MWOOGOJBHIARFG-UHFFFAOYSA-N COC1=C(C=CC(=C1)C=O)O
vanillic acid mono 8468 WKOLLVMJNQIZCI-UHFFFAOYSA-N COC1=C(C=CC(=C1)C(=O)O)O
Vaniline-like mixture MWOOGOJBHIARFG-UHFFFAOYSA-N LPIRKPUURBAM ... COC1=C(C=CC(=C1)C=O)O CC(=O)OC1=C(C=CC(= ...
Ureidopropionic acid 464-88-4 mono 111 JSJWCHRYRHKBBW-UHFFFAOYSA-N C(CNC(=O)N)C(=O)O
Ureidoisobutyric acid 2905-86-4 sum of isomers 160663 PHENTZNALBMCQD-UHFFFAOYSA-N CC(CNC(=O)N)C(=O)O
Urea 57-13-6 mono 1176 XSQUKJJJFZCRTK-UHFFFAOYSA-N C(=O)(N)N
undecene-2-nitrile sum of isomers 90817 HETFMJQWNWIBPN-UHFFFAOYSA-N CCCCCCCCC=CC#N
undecavertol 81782-77-6 mono 6441135 WSTQLNQRVZNEDV-CSKARUKUSA-N CCCCCC(/C(=C/CC)/C)O
Undecanol mono 8184 KJIOQYGWTQBHNH-UHFFFAOYSA-N CCCCCCCCCCCO
Undecanoic acid mono 8180 ZDPHROOEEOARMN-UHFFFAOYSA-N CCCCCCCCCCC(=O)O
Undecanedioic acid mono 15816 LWBHHRRTOZQPDM-UHFFFAOYSA-N C(CCCCC(=O)O)CCCCC(=O)O
undecanal 112-44-7 mono 8186 KMPQYAYAQWNLME-UHFFFAOYSA-N CCCCCCCCCCC=O
trimethylamine mono 1146 GETQZCLCWQTVFV-UHFFFAOYSA-N CN(C)C
triethylamine mono 8471 ZMANZCXQSJIPKH-UHFFFAOYSA-N CCN(CC)CC
Traseolide sum of isomers 91696 IMRYETFJNLKUHK-UHFFFAOYSA-N CC1C(C2=C(C1(C)C)C=C(C(=C2)C(=O)C)C)C(C) ...
Trans-cinnamic acid mono 444539 WBYWAXJHAXSJNI-VOTSOKGWSA-N C1=CC=C(C=C1)/C=C/C(=O)O
Trans-2-octenal mono 5283324 LVBXEMGDVWVTGY-VOTSOKGWSA-N CCCCC/C=C/C=O
trans-2-Nonenal mono 5283335 BSAIUMLZVGUGKX-BQYQJAHWSA-N CCCCCC/C=C/C=O
trans-2-Dodecenal mono 5283361 SSNZFFBDIMUILS-ZHACJKMWSA-N CCCCCCCCC/C=C/C=O
trans,trans-2,4-octadienal mono 5283329 DVVATNQISMINCX-YTXTXJHMSA-N CCC/C=C/C=C/C=O
trans,trans-2,4-Nonadienal mono 5283339 ZHHYXNZJDGDGPJ-BSWSSELBSA-N CCCC/C=C/C=C/C=O
tonalide sum of isomers 89440 DNRJTBAOUJJKDY-UHFFFAOYSA-N CC1CC(C2=C(C1(C)C)C=C(C(=C2)C(=O)C)C)(C) ...