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Coumarin 153
SpectraBase Compound ID dqI9WIMjmZ
InChI InChI=1S/C16H14F3NO2/c17-16(18,19)12-8-13(21)22-15-10-4-2-6-20-5-1-3-9(14(10)20)7-11(12)15/h7-8H,1-6H2
InChIKey VSSSHNJONFTXHS-UHFFFAOYSA-N
Mol Weight 309.29 g/mol
Molecular Formula C16H14F3NO2
Exact Mass 309.097663 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B13hdSlo1Fw
Name 9-(Trifluoromethyl)-2,3,6,7-tetrahydro-1H,5H,11H-pyrano[2,3-f]pyrido[3,2,1-ij]quinolin-11-one
Alternate Name(s) Coumarin 153 Coumarin 495 Coumarin 540A Coumarin 6F Pilot 495 C 153 C 6F K 153 EINECS 258-600-5 NSC 338964
CAS Registry Number 53518-18-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14F3NO2
InChI InChI=1S/C16H14F3NO2/c17-16(18,19)12-8-13(21)22-15-10-4-2-6-20-5-1-3-9(14(10)20)7-11(12)15/h7-8H,1-6H2
InChIKey VSSSHNJONFTXHS-UHFFFAOYSA-N
Molecular Weight 309.288 g/mol
SMILES C1CN2c3c(CCC2)cc2c(c3C1)OC(C=C2C(F)(F)F)=O
SPLASH splash10-0a59-5966000000-cf786ad1da2463d7b105
Source of Spectrum AD-0-2532-0
Wiley ID 1423252