Name:
Adduct:
Polarity:
Z:
m/z:
±:
CCS: Ã…
±: %
SMI:

Make a CSV file containing information about your queries.
Then upload the CSV file below and click on "Make Queries" to view the results online
and click "Download Results" to download the entire results in one excel file.
An example of the CSV file can be found below

Download Example CSV


**Make sure the header column names are as follows**

...



Upload a CSV file

ID Name Adduct Structure m/z RT CCS SMI Type Z Ref CCS Type CCS method
CCSBASE_7ace5c9dccbc00da21000d32680af83c Hexazinone [M+H]+ 253.1659 0.86 160.31 CN1C(=NC(=O)N(C1=O)C2CCCCC2)N(C)C Organic nitrogen compounds 1 1 TW polyala
CCSBASE_4dac94d959f5625d977521a3a3c8e568 Hexazinone [M+Na]+ 275.1478 0.83 173.26 CN1C(=NC(=O)N(C1=O)C2CCCCC2)N(C)C Organic nitrogen compounds 1 1 TW polyala
CCSBASE_1534823629225f1cbcbdbf068047f654 Forchlorfenuron [M+H]+ 248.0585 0.89 155.06 C1=CC=C(C=C1)NC(=O)NC2=CC(=NC=C2)Cl   Organoheterocyclic compounds 1 1 TW polyala
CCSBASE_d8cfbdeed21f1ad14c30aad57f2fa38a Cyclanilide [M+H]+ 274.0032 0.95 155.14 C1CC1(C(=O)NC2=C(C=C(C=C2)Cl)Cl)C(=O)O Benzenoids 1 1 TW polyala
CCSBASE_eef4f8885caabe41d436813b94cff9f7 Cyclanilide [M+H-H2O]+ 255.9927 0.95 147.31 C1CC1(C(=O)NC2=C(C=C(C=C2)Cl)Cl)C(=O)O Benzenoids 1 1 TW polyala
CCSBASE_8f59051a5e06335f56f01b70fc2c1e74 Fluridone [M+H]+ 330.11 0.88 178.75 CN1C=C(C(=O)C(=C1)C2=CC(=CC=C2)C(F)(F)F)C3=CC=CC=C3 Organoheterocyclic compounds 1 1 TW polyala
CCSBASE_65c33a9022869e5dc3eecbd4766ccc52 Fluridone [M+H-H2O]+ 312.0995 0.88 169.17 CN1C=C(C(=O)C(=C1)C2=CC(=CC=C2)C(F)(F)F)C3=CC=CC=C3 Organoheterocyclic compounds 1 1 TW polyala
CCSBASE_2ad483a95a16ca92e0d6c3e47b314cf7 Fluridone [M+Na]+ 352.092 0.91 186.15 CN1C=C(C(=O)C(=C1)C2=CC(=CC=C2)C(F)(F)F)C3=CC=CC=C3 Organoheterocyclic compounds 1 1 TW polyala
CCSBASE_6063cf9bd375ca423f8d6bdb16503049 Fluazifop-butyl [M+H]+ 384.1417 1.03 193.56 CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F Benzenoids 1 1 TW polyala
CCSBASE_5e095c391125d86e433fd9acc49a5fcd Fluazifop-butyl [M+Na]+ 406.1237 1.03 191.33 CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F Benzenoids 1 1 TW polyala
1 2 ... 30 31 32 33 34 35 36 ... 359 360