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4a(2H)-Phenanthrenemethanol, 1,3,4,9,10,10a-hexahydro-6-methoxy-1,1-dimethyl-7-(1-methylethyl)-, (4aR-trans)-
SpectraBase Compound ID DKk5cY1JCif
InChI InChI=1S/C21H32O2/c1-14(2)16-11-15-7-8-19-20(3,4)9-6-10-21(19,13-22)17(15)12-18(16)23-5/h11-12,14,19,22H,6-10,13H2,1-5H3
InChIKey HTZAHUFMXXGPML-UHFFFAOYSA-N
Mol Weight 316.5 g/mol
Molecular Formula C21H32O2
Exact Mass 316.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DerJ1WTg4HV
Name 4a(2H)-Phenanthrenemethanol, 1,3,4,9,10,10a-hexahydro-6-methoxy-1,1-dimethyl-7-(1-methylethyl)-, (4aR-trans)-
CAS Registry Number 57397-36-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O2
InChI InChI=1S/C21H32O2/c1-14(2)16-11-15-7-8-19-20(3,4)9-6-10-21(19,13-22)17(15)12-18(16)23-5/h11-12,14,19,22H,6-10,13H2,1-5H3
InChIKey HTZAHUFMXXGPML-UHFFFAOYSA-N
Molecular Weight 316.485 g/mol
SMILES OCC12CCCC(C)(C)C2CCc2cc(c(cc12)OC)C(C)C
SPLASH splash10-014i-1759000000-eee7de9133f4ce7c6deb
Source of Spectrum EP-7956-0-0
Synonyms 12-Methoxyabieta-8,11,13-trien-20-ol (6-methoxy-1,1-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-4a-yl)methanol (7-isopropyl-6-methoxy-1,1-dimethyl-2,3,4,9,10,10a-hexahydrophenanthren-4a-yl)methanol
Wiley ID 1317221