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Heptacosane

View entire compound with spectra: 2 NMR, 4 FTIR, and 24 MS (GC)

Heptacosane
SpectraBase Compound ID AWNMnxueAJc
InChI InChI=1S/C27H56/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-27H2,1-2H3
InChIKey BJQWYEJQWHSSCJ-UHFFFAOYSA-N
Mol Weight 380.7 g/mol
Molecular Formula C27H56
Exact Mass 380.438202 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9nTgew95bkG
Name Heptacosane
CAS Registry Number 593-49-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H56
InChI InChI=1S/C27H56/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-27H2,1-2H3
InChIKey BJQWYEJQWHSSCJ-UHFFFAOYSA-N
Molecular Weight 380.745 g/mol
SMILES CCCCCCCCCCCCCCCCCCCCCCCCCCC
SPLASH splash10-0596-9000000000-9f391f5d88e193640d0e
Source of Spectrum Va-0-0-0
Synonyms n-Heptacosane AI3-36283 EINECS 209-792-4
Wiley ID 738901