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3-Methyl-18-nor-abieta-2,8,11,13-tetraene
SpectraBase Compound ID 2amsTxRTZrE
InChI InChI=1S/C20H28/c1-13(2)16-6-9-19-17(12-16)7-8-18-15(4)14(3)10-11-20(18,19)5/h6,9-10,12-13,15,18H,7-8,11H2,1-5H3/t15-,18-,20-/m0/s1
InChIKey HPZBYPYFDGSPDU-QSFXBCCZSA-N
Mol Weight 268.44 g/mol
Molecular Formula C20H28
Exact Mass 268.219101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JX0xZWEcSFT
Name 3-Methyl-18-nor-abieta-2,8,11,13-tetraene
Alternate Name(s) (1R,4aS,10aS)-7-isopropyl-1,2,4a-trimethyl-1,4,4a,9,10,10a-hexahydrophenanthrene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28
InChI InChI=1S/C20H28/c1-13(2)16-6-9-19-17(12-16)7-8-18-15(4)14(3)10-11-20(18,19)5/h6,9-10,12-13,15,18H,7-8,11H2,1-5H3/t15-,18-,20-/m0/s1
InChIKey HPZBYPYFDGSPDU-QSFXBCCZSA-N
Molecular Weight 268.444 g/mol
SMILES [C@@]12([C@]([C@](C)([H])C(=CC2)C)(CCc2c1ccc(C(C)C)c2)[H])C
SPLASH splash10-000i-0920000000-c526af27e6137e1d06c2
Source of Spectrum X2-56-1464-14
Wiley ID 1605075