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1-(1,3-n-octadienyl)-3-(5-((4,6-dimethyl-2-pyrimidinyl)amino)pentyl)-carbamylcyclopropene

View entire compound with spectra: 1 MS (GC)

1-(1,3-n-octadienyl)-3-(5-((4,6-dimethyl-2-pyrimidinyl)amino)pentyl)-carbamylcyclopropene
SpectraBase Compound ID 18PvZEJnLpE
InChI InChI=1S/C23H34N4O/c1-4-5-6-7-8-10-13-20-17-21(20)22(28)24-14-11-9-12-15-25-23-26-18(2)16-19(3)27-23/h7-8,10,13,16-17,21H,4-6,9,11-12,14-15H2,1-3H3,(H,24,28)(H,25,26,27)/b8-7+,13-10-
InChIKey ZNTCRWQRCBIBOB-JXQIQDKBSA-N
Mol Weight 382.6 g/mol
Molecular Formula C23H34N4O
Exact Mass 382.273262 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1evueAC9YMh
Name 1-(1,3-n-octadienyl)-3-(5-((4,6-dimethyl-2-pyrimidinyl)amino)pentyl)-carbamylcyclopropene
Alternate Name(s) N-{5-[(4,6-dimethyl-2-pyrimidinyl)amino]pentyl}-2-[(1Z,3E)-1,3-octadienyl]-2-cyclopropene-1-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H34N4O
InChI InChI=1S/C23H34N4O/c1-4-5-6-7-8-10-13-20-17-21(20)22(28)24-14-11-9-12-15-25-23-26-18(2)16-19(3)27-23/h7-8,10,13,16-17,21H,4-6,9,11-12,14-15H2,1-3H3,(H,24,28)(H,25,26,27)/b8-7+,13-10-
InChIKey ZNTCRWQRCBIBOB-JXQIQDKBSA-N
Molecular Weight 382.552 g/mol
SMILES N(C(C1C(=C1)\C=C/C=C/CCCC)=O)CCCCCNc1nc(C)cc(n1)C
SPLASH splash10-007c-1913000000-5615283899c0f199c489
Source of Spectrum CH-1980-109-16
Wiley ID 1360728