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Naphtho[2',1':6,7]phenanthro[1,2-b]oxirene, 1a,12,13,13a-tetrahydro-, (.+-.)-
SpectraBase Compound ID 2sosL3hLMdQ
InChI InChI=1S/C22H16O/c1-2-4-17-13(3-1)5-7-15-12-19-16(11-18(15)17)8-6-14-9-10-20-22(23-20)21(14)19/h1-8,11-12,20,22H,9-10H2
InChIKey BKOLVXBBDHBTJY-UHFFFAOYSA-N
Mol Weight 296.37 g/mol
Molecular Formula C22H16O
Exact Mass 296.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BiHrACX5j2P
Name Naphtho[2',1':6,7]phenanthro[1,2-b]oxirene, 1a,12,13,13a-tetrahydro-, (.+-.)-
Alternate Name(s) (+-)-1,2,3,4-Tetrahydro-1,2-epoxydibenz[a,h]anthracene 1a,2,3,13c-tetrahydronaphtho[2',1':6,7]phenanthro[3,4-b]oxirene
CAS Registry Number 127239-55-8
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16O
InChI InChI=1S/C22H16O/c1-2-4-17-13(3-1)5-7-15-12-19-16(11-18(15)17)8-6-14-9-10-20-22(23-20)21(14)19/h1-8,11-12,20,22H,9-10H2
InChIKey BKOLVXBBDHBTJY-UHFFFAOYSA-N
Molecular Weight 296.369 g/mol
SMILES C12OC2CCc2c1c1cc3ccc4c(c3cc1cc2)cccc4
SPLASH splash10-0002-0090000000-484c85a2395673dc0947
Source of Spectrum KC-1989-2232-1
Wiley ID 1299794