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3.beta.-Methyl-3.alpha.-chloro-18-nor-abieta-8,11,13-triene
SpectraBase Compound ID Hw1DkwKrYns
InChI InChI=1S/C20H29Cl/c1-13(2)15-6-9-18-16(12-15)7-8-17-14(3)20(5,21)11-10-19(17,18)4/h6,9,12-14,17H,7-8,10-11H2,1-5H3/t14-,17+,19+,20+/m1/s1
InChIKey CPWGLXZGECGION-UDDICAGYSA-N
Mol Weight 304.91 g/mol
Molecular Formula C20H29Cl
Exact Mass 304.195779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID p5n3bBl44L
Name 3.beta.-Methyl-3.alpha.-chloro-18-nor-abieta-8,11,13-triene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H29Cl
InChI InChI=1S/C20H29Cl/c1-13(2)15-6-9-18-16(12-15)7-8-17-14(3)20(5,21)11-10-19(17,18)4/h6,9,12-14,17H,7-8,10-11H2,1-5H3/t14-,17+,19+,20+/m1/s1
InChIKey CPWGLXZGECGION-UDDICAGYSA-N
Molecular Weight 304.905 g/mol
SMILES [C@@]12([C@]([C@](C)([H])[C@](CC2)(Cl)C)(CCc2c1ccc(C(C)C)c2)[H])C
SPLASH splash10-0f79-0491000000-5d0b48d5e5f8f1f8b691
Source of Spectrum X2-56-1464-0
Synonyms (1R,2S,4aS,10aS)-2-chloro-7-isopropyl-1,2,4a-trimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthrene
Wiley ID 1605074