For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

n-Heptane

View entire compound with spectra: 111 NMR, 13 FTIR, 1 Raman, 37 MS (GC), and 2 Near IR

n-Heptane
SpectraBase Compound ID F6dQw2iZVxu
InChI InChI=1S/C7H16/c1-3-5-7-6-4-2/h3-7H2,1-2H3
InChIKey IMNFDUFMRHMDMM-UHFFFAOYSA-N
Mol Weight 100.2 g/mol
Molecular Formula C7H16
Exact Mass 100.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID DGQG8trBUgY
Name Heptane
CAS Registry Number 142-82-5
Classification Alkanes
Copyright Copyright © 2016-2024  John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H16
InChI InChI=1S/C7H16/c1-3-5-7-6-4-2/h3-7H2,1-2H3
InChIKey IMNFDUFMRHMDMM-UHFFFAOYSA-N
Number of Peaks 45
RI1 700
RI4 700
RI5 377
SMILES CCCCCCC
SPLASH splash10-052f-9000000000-4b9c5df638e005e1371f
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Heptane
Wiley ID LM_LIPIDS2016_1