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1-Oxo-1,2,3,3a-tetrahydrobenzo[b]fluoranthene
SpectraBase Compound ID EKPOEx6ourI
InChI InChI=1S/C20H14O/c21-18-10-9-16-14-7-3-4-8-15(14)17-11-12-5-1-2-6-13(12)20(18)19(16)17/h1-8,11,16H,9-10H2
InChIKey XVIUQSXDAIPXFF-UHFFFAOYSA-N
Mol Weight 270.33 g/mol
Molecular Formula C20H14O
Exact Mass 270.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1oA3ptNZSP6
Name 1-Oxo-1,2,3,3a-tetrahydrobenzo[b]fluoranthene
Alternate Name(s) 3,3a-dihydrobenzo[e]acephenanthrylen-1(2H)-one
CAS Registry Number 88746-52-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H14O
InChI InChI=1S/C20H14O/c21-18-10-9-16-14-7-3-4-8-15(14)17-11-12-5-1-2-6-13(12)20(18)19(16)17/h1-8,11,16H,9-10H2
InChIKey XVIUQSXDAIPXFF-UHFFFAOYSA-N
Molecular Weight 270.331 g/mol
SMILES c12c3-c4ccccc4C2CCC(c1c1c(cccc1)c3)=O
SPLASH splash10-00b9-0090000000-9a18f55e226f03a86200
Source of Spectrum J-49-1094-0
Wiley ID 1274978