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2-[4-(Nonyloxy)phenyl]-5-octylpyrimidine
SpectraBase Compound ID ASDDLqSm4QU
InChI InChI=1S/C27H42N2O/c1-3-5-7-9-11-13-15-21-30-26-19-17-25(18-20-26)27-28-22-24(23-29-27)16-14-12-10-8-6-4-2/h17-20,22-23H,3-16,21H2,1-2H3
InChIKey IWZAFMARMJZJDW-UHFFFAOYSA-N
Mol Weight 410.6 g/mol
Molecular Formula C27H42N2O
Exact Mass 410.329714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BXcU8BmqSDK
Name 2-[4-(Nonyloxy)phenyl]-5-octylpyrimidine
Alternate Name(s) 2-(4-nonoxyphenyl)-5-octyl-pyrimidine Pyrimidine, 2-[4-(nonyloxy)phenyl]-5-octyl-
CAS Registry Number 57202-51-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H42N2O
InChI InChI=1S/C27H42N2O/c1-3-5-7-9-11-13-15-21-30-26-19-17-25(18-20-26)27-28-22-24(23-29-27)16-14-12-10-8-6-4-2/h17-20,22-23H,3-16,21H2,1-2H3
InChIKey IWZAFMARMJZJDW-UHFFFAOYSA-N
Molecular Weight 410.646 g/mol
SMILES C(CCCCCCCOc1ccc(cc1)-c1ncc(cn1)CCCCCCCC)C
SPLASH splash10-000i-4920000000-87aeeae3f63611601d6a
Wiley ID 1476017