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5-Heptyl-2-[4-(nonyloxy)phenyl]pyrimidine
SpectraBase Compound ID FPl3NhADQgx
InChI InChI=1S/C26H40N2O/c1-3-5-7-9-10-12-14-20-29-25-18-16-24(17-19-25)26-27-21-23(22-28-26)15-13-11-8-6-4-2/h16-19,21-22H,3-15,20H2,1-2H3
InChIKey OGFGFVYUTGSNAF-UHFFFAOYSA-N
Mol Weight 396.6 g/mol
Molecular Formula C26H40N2O
Exact Mass 396.314064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AtGG0Ohit1a
Name 5-Heptyl-2-[4-(nonyloxy)phenyl]pyrimidine
Alternate Name(s) 5-Heptyl-2-(4-nonoxyphenyl)pyrimidine Pyrimidine, 5-heptyl-2-[4-(nonyloxy)phenyl]-
CAS Registry Number 57202-40-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H40N2O
InChI InChI=1S/C26H40N2O/c1-3-5-7-9-10-12-14-20-29-25-18-16-24(17-19-25)26-27-21-23(22-28-26)15-13-11-8-6-4-2/h16-19,21-22H,3-15,20H2,1-2H3
InChIKey OGFGFVYUTGSNAF-UHFFFAOYSA-N
Molecular Weight 396.619 g/mol
SMILES C(CCCCCCCOc1ccc(cc1)-c1ncc(cn1)CCCCCCC)C
SPLASH splash10-0079-3952000000-0bf859e32df2abf0e601
Wiley ID 1476122