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2-(1-Adamantyl)-2H-1,2,3-triazole-4,5-dicarboxylic acid
SpectraBase Compound ID CavYHsAqrPC
InChI InChI=1S/C14H17N3O4/c18-13(19)10-11(14(20)21)16-17(15-10)12-8-2-6-1-7(4-8)5-9(12)3-6/h6-9,12H,1-5H2,(H,18,19)(H,20,21)/t6-,7+,8-,9+,12?
InChIKey RNQGEROUNMIDEE-QPNCSPCISA-N
Mol Weight 291.31 g/mol
Molecular Formula C14H17N3O4
Exact Mass 291.121906 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7HvjfBxU2co
Name 2-(1-ADAMANTYL)-2H-1,2,3-TRIAZOLE-4,5-DICARBOXYLIC ACID
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H17N3O4
InChI InChI=1S/C14H17N3O4/c18-13(19)10-11(14(20)21)16-17(15-10)12-8-2-6-1-7(4-8)5-9(12)3-6/h6-9,12H,1-5H2,(H,18,19)(H,20,21)/t6-,7+,8-,9+,12?
InChIKey RNQGEROUNMIDEE-QPNCSPCISA-N
Molecular Weight 291.1215
SMILES OC(c1n[n](nc1C(O)=O)C1[C@]2(C[C@]3(C[C@@]1(C[C@](C3)(C2)[H])[H])[H])[H])=O
SPLASH splash10-000f-9300000000-471ddaf6475e3a00a70a
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany