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

*Links on SpectraBase are not permalinks.

(3aR,3bR,4aR,5aR)-3,4,4-Trimethyl-1-(4,6-dimethyl-2-pyrimidyl)-1,3a,3b,4,4a,5-hexahydrocyclopropa[3,4]cyclopenta[1,2-c]pyrazol-5a-ol

View entire compound with spectra: 1 MS (GC)

(3aR,3bR,4aR,5aR)-3,4,4-Trimethyl-1-(4,6-dimethyl-2-pyrimidyl)-1,3a,3b,4,4a,5-hexahydrocyclopropa[3,4]cyclopenta[1,2-c]pyrazol-5a-ol
SpectraBase Compound ID CJGAHTFArVA
InChI InChI=1S/C16H22N4O/c1-8-6-9(2)18-14(17-8)20-16(21)7-11-13(15(11,4)5)12(16)10(3)19-20/h6,11-13,21H,7H2,1-5H3/t11-,12+,13-,16+/m1/s1
InChIKey QYHISDZBDMXIFN-IATRGZMQSA-N
Mol Weight 286.38 g/mol
Molecular Formula C16H22N4O
Exact Mass 286.179361 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 LFX3TT8IwO6
Name (3aR,3bR,4aR,5aR)-3,4,4-Trimethyl-1-(4,6-dimethyl-2-pyrimidyl)-1,3a,3b,4,4a,5-hexahydrocyclopropa[3,4]cyclopenta[1,2-c]pyrazol-5a-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22N4O
InChI InChI=1S/C16H22N4O/c1-8-6-9(2)18-14(17-8)20-16(21)7-11-13(15(11,4)5)12(16)10(3)19-20/h6,11-13,21H,7H2,1-5H3/t11-,12+,13-,16+/m1/s1
InChIKey QYHISDZBDMXIFN-IATRGZMQSA-N
Molecular Weight 286.379 g/mol
SMILES O[C@]12N(c3nc(C)cc(n3)C)N=C(C)[C@]1([C@@]1([H])[C@](C1(C)C)(C2)[H])[H]
SPLASH splash10-0udr-0490000000-99dcff8c65a863fdfde4
Source of Spectrum F-53-17742-7
Synonyms (3aR,3bR,4aR,5aR)-1-(4,6-dimethyl-2-pyrimidinyl)-3,4,4-trimethyl-1,3a,3b,4,4a,5-hexahydro-5aH-cyclopropa[3,4]cyclopenta[1,2-c]pyrazol-5a-ol (3aR,3bR,4aR,5aS)-3,4,4-Trimethyl-1-(4,6-dimethyl-2-pyrimidyl)-1,3a,3b,4,4a,5-hexahydrocyclopropa[3,4]cyclopenta[1,2-c]pyrazol-5a-ol
Wiley ID 804998