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Chrysene, 11-(3-butenyl)-1,2,3,4-tetrahydro-, monopicrate
SpectraBase Compound ID IiuW9jQrLhM
InChI InChI=1S/C22H22.C6H3N3O7/c1-2-3-8-18-15-17-10-5-6-11-19(17)21-14-13-16-9-4-7-12-20(16)22(18)21;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h2,4,7,9,12-15H,1,3,5-6,8,10-11H2;1-2,10H
InChIKey GAHGAZVIFGMOHQ-UHFFFAOYSA-N
Mol Weight 515.52 g/mol
Molecular Formula C28H25N3O7
Exact Mass 515.16925 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DUs4q8vPZ2u
Name Chrysene, 11-(3-butenyl)-1,2,3,4-tetrahydro-, monopicrate
CAS Registry Number 18930-76-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H25N3O7
InChI InChI=1S/C22H22.C6H3N3O7/c1-2-3-8-18-15-17-10-5-6-11-19(17)21-14-13-16-9-4-7-12-20(16)22(18)21;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h2,4,7,9,12-15H,1,3,5-6,8,10-11H2;1-2,10H
InChIKey GAHGAZVIFGMOHQ-UHFFFAOYSA-N
Molecular Weight 515.522 g/mol
SMILES c12c(c(CCC=C)cc3c2CCCC3)c2ccccc2cc1.Oc1c(N(=O)=O)cc(N(=O)=O)cc1N(=O)=O
SPLASH splash10-000i-0190000000-02eb4c6743f66aa42676
Source of Spectrum AD-0-1261-0
Synonyms 11-(but-3-enyl)-1,2,3,4-tetrahydrochrysene picrate 2,4,6-trinitrophenol compound with 11-(3-butenyl)-1,2,3,4-tetrahydrochrysene (1:1)
Wiley ID 63466