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1-Pentyl-2-methylbenzene
SpectraBase Compound ID Bp7mVHjZh7T
InChI InChI=1S/C12H18/c1-3-4-5-9-12-10-7-6-8-11(12)2/h6-8,10H,3-5,9H2,1-2H3
InChIKey NQVHSBDSEAYZOO-UHFFFAOYSA-N
Mol Weight 162.28 g/mol
Molecular Formula C12H18
Exact Mass 162.140851 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6zmLEB0Ao6F
Name 1-Pentyl-2-methylbenzene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 162.140850580 u
Formula C12H18
InChI InChI=1S/C12H18/c1-3-4-5-9-12-10-7-6-8-11(12)2/h6-8,10H,3-5,9H2,1-2H3
InChIKey NQVHSBDSEAYZOO-UHFFFAOYSA-N
Molecular Weight 162.276 g/mol
SMILES c1(c(cccc1)C)CCCCC