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Chrysene, 1,2,3,4,4a,7,8,9,10,11,12,12a-dodecahydro-6-octyl-
SpectraBase Compound ID ECfmVjqxL9Z
InChI InChI=1S/C26H40/c1-2-3-4-5-6-7-13-21-19-26-22-14-9-8-12-20(22)17-18-25(26)24-16-11-10-15-23(21)24/h19-20,22H,2-18H2,1H3
InChIKey QMLSEQMTIVHKQP-UHFFFAOYSA-N
Mol Weight 352.6 g/mol
Molecular Formula C26H40
Exact Mass 352.313001 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7XX8TO5mmvq
Name Chrysene, 1,2,3,4,4a,7,8,9,10,11,12,12a-dodecahydro-6-octyl-
Alternate Name(s) 6-Octyl-1,2,3,4,4a,7,8,9,10,11,12,12a-dodecahydrochrysene 12-n-Octyl-1,2,3,4,5,6,6a,7,8,9,10,10a-dodecahydrochrysene
CAS Registry Number 55281-94-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H40
InChI InChI=1S/C26H40/c1-2-3-4-5-6-7-13-21-19-26-22-14-9-8-12-20(22)17-18-25(26)24-16-11-10-15-23(21)24/h19-20,22H,2-18H2,1H3
InChIKey QMLSEQMTIVHKQP-UHFFFAOYSA-N
Molecular Weight 352.606 g/mol
SMILES CCCCCCCCc1cc2c(CCC3C2CCCC3)c2c1CCCC2
SPLASH splash10-0udi-7977000000-d64290f79c92d446f7f1
Source of Spectrum EP-3758-0-0
Wiley ID 1343750