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Methyl 9-phenanthroate

View entire compound with spectra: 1 NMR, and 4 MS (GC)

Methyl 9-phenanthroate
SpectraBase Compound ID LVhSHhH4xcN
InChI InChI=1S/C16H12O2/c1-18-16(17)15-10-11-6-2-3-7-12(11)13-8-4-5-9-14(13)15/h2-10H,1H3
InChIKey ZIRPXQWFLFUQQM-UHFFFAOYSA-N
Mol Weight 236.27 g/mol
Molecular Formula C16H12O2
Exact Mass 236.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ZB4ED6Xztz
Name 9-Phenanthrenecarboxylic acid methyl ester
CAS Registry Number 1217-49-8
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12O2
InChI InChI=1S/C16H12O2/c1-18-16(17)15-10-11-6-2-3-7-12(11)13-8-4-5-9-14(13)15/h2-10H,1H3
InChIKey ZIRPXQWFLFUQQM-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201200569
Molecular Weight 236.270 g/mol
SMILES c1c2cc(C(OC)=O)c3c(cccc3)c2ccc1
SPLASH splash10-052r-1290000000-c1a1e9c520558e73fdad
Source of Spectrum ASC-354-3195/SM8-4aa
Synonyms Methyl 9-phenanthrenecarboxylate Methyl phenanthrene-9-carboxylate Methyl 9-phenanthroate Phenanthrene-9-carboxylic acid methyl ester
Wiley ID 1762798