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3-Octadecanone
SpectraBase Compound ID 6m5t3KzodDB
InChI InChI=1S/C18H36O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)4-2/h3-17H2,1-2H3
InChIKey LMCGARAPKXJPNG-UHFFFAOYSA-N
Mol Weight 268.5 g/mol
Molecular Formula C18H36O
Exact Mass 268.276616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G4rcN1a211v
Name 3-Octadecanone
CAS Registry Number 18261-92-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H36O
InChI InChI=1S/C18H36O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)4-2/h3-17H2,1-2H3
InChIKey LMCGARAPKXJPNG-UHFFFAOYSA-N
Molecular Weight 268.485 g/mol
SMILES C(CCCCCCCCCCC(=O)CC)CCCC
SPLASH splash10-05fu-9000000000-7f2e99ce279f9f267122
Source of Spectrum NP-8-2268-0
Synonyms Octadecan-3-one EINECS 242-132-3
Wiley ID 1107142