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3-(1-adamantyl)-6-amino-4-(4-fluorophenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
SpectraBase Compound ID Gsob5Y8dVY5
InChI InChI=1S/C23H23FN4O/c24-16-3-1-15(2-4-16)18-17(11-25)21(26)29-22-19(18)20(27-28-22)23-8-12-5-13(9-23)7-14(6-12)10-23/h1-4,12-14,18H,5-10,26H2,(H,27,28)/t12-,13+,14-,18?,23-
InChIKey QQLMQVMIPUAYAI-IBFSXQSYSA-N
Mol Weight 390.46 g/mol
Molecular Formula C23H23FN4O
Exact Mass 390.18559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1lSLfl17WNN
Name 3-(1-adamantyl)-6-amino-4-(4-fluorophenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Alternate Name(s) 3-(1-adamantyl)-6-azanyl-4-(4-fluorophenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H23FN4O
InChI InChI=1S/C23H23FN4O/c24-16-3-1-15(2-4-16)18-17(11-25)21(26)29-22-19(18)20(27-28-22)23-8-12-5-13(9-23)7-14(6-12)10-23/h1-4,12-14,18H,5-10,26H2,(H,27,28)/t12-,13+,14-,18?,23-
InChIKey QQLMQVMIPUAYAI-IBFSXQSYSA-N
Molecular Weight 390.462 g/mol
SMILES NC1=C(C(c2c(O1)[nH]nc2C12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])c1ccc(cc1)F)C#N
SPLASH splash10-0002-6391000000-38fdd41c887429fa41aa
Wiley ID 1453176