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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 B1r9FCgdHsv
Name Heptacosane
CAS Registry Number 593-49-7
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 380.438201803 u
Formula C27H56
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness)
GC Oven Program 60 °C to 246 °C at 3 °C/min.
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
Nominal Mass 380 u
Number of Peaks 70
SMILES C(CCCCCCCCCCCCCC)CCCCCCCCCCCC
SPLASH splash10-0a4l-9000000000-9562b9ff41d3970cc207
Source ex PARAFILM
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA001664