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1-Methylcoronene

View entire compound with spectra: 2 MS (GC)

1-Methylcoronene
SpectraBase Compound ID 5t8mVuJwHSg
InChI InChI=1S/C25H14/c1-13-12-18-9-8-16-5-3-14-2-4-15-6-7-17-10-11-19(13)25-23(17)21(15)20(14)22(16)24(18)25/h2-12H,1H3
InChIKey NYAQPDBIWGCXLE-UHFFFAOYSA-N
Mol Weight 314.39 g/mol
Molecular Formula C25H14
Exact Mass 314.10955 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GKXtSVvZzfs
Name 1-Methylcoronene
Alternate Name(s) Coronene, methyl- Methylcoronene
CAS Registry Number 13119-86-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H14
InChI InChI=1S/C25H14/c1-13-12-18-9-8-16-5-3-14-2-4-15-6-7-17-10-11-19(13)25-23(17)21(15)20(14)22(16)24(18)25/h2-12H,1H3
InChIKey NYAQPDBIWGCXLE-UHFFFAOYSA-N
Molecular Weight 314.387 g/mol
SMILES c1c2c3c4c5c6c(ccc5ccc4c1)ccc1c6c3c(cc2)cc1C
SPLASH splash10-03di-0119000000-a520d518b344e95b143b
Wiley ID 1502508