BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
Member of WWPDB

Nonadecane

Nonadecane synonyms

n-nonadecane; CH3-[CH2]17-CH3; n-Nonadecane; Nonadekan; nonadecane

Wikipedia:

Graphical representations:

nonadecane

View large 3D structure

Molecular Formula: C19H40

Natural Isotopic Abundance Mass: 268.5209

Mono-Isotopic Molecular Masses:

  • C12N14: 268.313001284
  • C13N14: 287.3767432022
  • C12N15: 268.313001284
  • C13N15: 287.3767432022

InChI string: InChI=1S/C19H40/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2/h3-19H2,1-2H3

MMCD: cq_19284
PubChem Compound (CID): 12401
CAS Registry number: 629-92-5
Sigma-Aldrich: N28906_ALDRICH
ChEBI: CHEBI:32927
KEGG Compound ID: N28906_ALDRICH
NIST Chemistry WebBook: 3213461469
NIST: 3213461469

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773)