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

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ID Name Adduct Structure m/z RT CCS SMI Type Z Ref CCS Type CCS method
CCSBASE_f24356c557b40c4d201a1f0d5ee62fe4 Carboxin [M+H]+ 236.074 0.85 150.54 CC1=C(SCCO1)C(=O)NC2=CC=CC=C2 Benzenoids 1 1 TW polyala
CCSBASE_ec705eb136d748b78c8368f77bacd851 Carboxin [M+H-H2O]+ 218.0635 0.85 142.1 CC1=C(SCCO1)C(=O)NC2=CC=CC=C2 Benzenoids 1 1 TW polyala
CCSBASE_4cc4b51c8dc78debb3b6eb64a09a0fb1 Carboxin [M+Na]+ 258.0559 0.85 162.45 CC1=C(SCCO1)C(=O)NC2=CC=CC=C2 Benzenoids 1 1 TW polyala
CCSBASE_85942e05ee28204ef805012cf1ed46b4 2,4,7,9-Tetramethyl-5-decyne-4,7-diol [M+FA-H]- 271.1915 0.95 169.4 CC(C)CC(C)(C#CC(C)(CC(C)C)O)O Organic oxygen compounds -1 1 TW polyala
CCSBASE_b3883f323583f6ae84a18df9d6565290 2,4,7,9-Tetramethyl-5-decyne-4,7-diol [M+H-H2O]+ 209.1901 0.95 154.3 CC(C)CC(C)(C#CC(C)(CC(C)C)O)O Organic oxygen compounds 1 1 TW polyala
CCSBASE_93d8cd1489ca980fc16087a69bc137f3 2,4,7,9-Tetramethyl-5-decyne-4,7-diol [M+Na]+ 249.1825 0.95 166.09 CC(C)CC(C)(C#CC(C)(CC(C)C)O)O Organic oxygen compounds 1 1 TW polyala
CCSBASE_42a22d328b324464c5567ddfd1478aea Triadimefon [M+H]+ 294.1004 0.91 170.89 CC(C)(C)C(=O)C(N1C=NC=N1)OC2=CC=C(C=C2)Cl Benzenoids 1 1 TW polyala
CCSBASE_3562fe90e76f9d22aec292c7c372eabd Triadimefon [M+K]+ 332.0563 0.95 173.49 CC(C)(C)C(=O)C(N1C=NC=N1)OC2=CC=C(C=C2)Cl Benzenoids 1 1 TW polyala
CCSBASE_fea2857f42bb1e2ec1355d6964e08787 Dicrotophos [M+H]+ 238.0839 0.73 147.76 C/C(=C\C(=O)N(C)C)/OP(=O)(OC)OC Organic acids and derivatives 1 1 TW polyala
CCSBASE_852cf0c50810048906100ad5b4350c3c Dicrotophos [M+Na]+ 260.0658 0.76 151.29 C/C(=C\C(=O)N(C)C)/OP(=O)(OC)OC Organic acids and derivatives 1 1 TW polyala
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