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1(2H)-Chrysenone, 3,4,4a,5,6,11,12,12a-octahydro-8-methoxy-, (4as-cis)-
SpectraBase Compound ID FQNCCyVeYdr
InChI InChI=1S/C19H22O2/c1-21-13-6-8-14-12(11-13)5-7-17-15-3-2-4-19(20)18(15)10-9-16(14)17/h6,8,11,15,18H,2-5,7,9-10H2,1H3
InChIKey UXBXQBRZGCHKGY-UHFFFAOYSA-N
Mol Weight 282.38 g/mol
Molecular Formula C19H22O2
Exact Mass 282.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Pu8WxHLOev
Name 1(2H)-Chrysenone, 3,4,4a,5,6,11,12,12a-octahydro-8-methoxy-, (4as-cis)-
Alternate Name(s) 8-Methoxy-3,4,4a,5,6,11,12,12a-octahydro-1(2H)-chrysenone 8-Methoxy-3,4,4a,5,6,11,12,12a-octahydro-2H-chrysen-1-one
CAS Registry Number 58072-55-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O2
InChI InChI=1S/C19H22O2/c1-21-13-6-8-14-12(11-13)5-7-17-15-3-2-4-19(20)18(15)10-9-16(14)17/h6,8,11,15,18H,2-5,7,9-10H2,1H3
InChIKey UXBXQBRZGCHKGY-UHFFFAOYSA-N
Molecular Weight 282.383 g/mol
SMILES COc1ccc2c(c1)CCC=1C3CCCC(C3CCC21)=O
SPLASH splash10-001i-3980000000-14725318124597c65255
Source of Spectrum W5-25290-0-0
Wiley ID 1286380