For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
tert-Butyl 2-(1-adamantyl)-4-iodo-1H-pyrrole-1-carboxylate
SpectraBase Compound ID 8w6E8Tvncpq
InChI InChI=1S/C19H26INO2/c1-18(2,3)23-17(22)21-11-15(20)7-16(21)19-8-12-4-13(9-19)6-14(5-12)10-19/h7,11-14H,4-6,8-10H2,1-3H3/t12-,13+,14-,19-
InChIKey XGHWRLPVYZDOPQ-KRFSREQESA-N
Mol Weight 427.33 g/mol
Molecular Formula C19H26INO2
Exact Mass 427.100824 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID KmD5vzppSnR
Name tert-Butyl 2-(1-adamantyl)-4-iodo-1H-pyrrole-1-carboxylate
Alternate Name(s) tert-Butyl 2-((3r,5r,7r)-adamantan-1-yl)-4-iodo-1H-pyrrole-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26INO2
InChI InChI=1S/C19H26INO2/c1-18(2,3)23-17(22)21-11-15(20)7-16(21)19-8-12-4-13(9-19)6-14(5-12)10-19/h7,11-14H,4-6,8-10H2,1-3H3/t12-,13+,14-,19-
InChIKey XGHWRLPVYZDOPQ-KRFSREQESA-N
Literature Reference DOI 10.1021/ol900581a
Molecular Weight 427.326 g/mol
SMILES C1[C@]2(CC3(c4[n](cc(c4)I)C(=O)OC(C)(C)C)C[C@@]1(C[C@](C3)(C2)[H])[H])[H]
SPLASH splash10-0a4i-9002000000-3626f6a7c551bba4a8af
Source of Spectrum A1-11-2269/SM20-4k
Wiley ID 1756785