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1-(1-adamantyl)-3,4,5-trimethylpyrazole
SpectraBase Compound ID 2VALR6j4axZ
InChI InChI=1S/C16H24N2/c1-10-11(2)17-18(12(10)3)16-7-13-4-14(8-16)6-15(5-13)9-16/h13-15H,4-9H2,1-3H3/t13-,14+,15-,16-
InChIKey NWLGSONMUGZEQJ-LDKKBFSKSA-N
Mol Weight 244.38 g/mol
Molecular Formula C16H24N2
Exact Mass 244.193949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CHBZxymLlA7
Name 1-Adamantyl-3,4,5-trimethyl-1H-pyrazole
Alternate Name(s) 1-((3s,5s,7s)-adamantan-1-yl)-3,4,5-trimethyl-1H-pyrazole 1-(1-adamantyl)-3,4,5-trimethylpyrazole
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Formula C16H24N2
InChI InChI=1S/C16H24N2/c1-10-11(2)17-18(12(10)3)16-7-13-4-14(8-16)6-15(5-13)9-16/h13-15H,4-9H2,1-3H3/t13-,14+,15-,16-
InChIKey NWLGSONMUGZEQJ-LDKKBFSKSA-N
Molecular Weight 244.382 g/mol
SMILES c1(n[n](c(c1C)C)C12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])C
SPLASH splash10-000l-3930000000-ee3fb85d82a4fac8dd53
Source of Spectrum HC-50-754-3a
Wiley ID 1739750