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7-BETA-HYDROXYMETHYL-ISOMER
SpectraBase Compound ID 5MQouFJKvvO
InChI InChI=1S/C22H32O3/c1-14(2)15-8-9-17-16(12-15)18(24-5)13-19-21(17,3)10-7-11-22(19,4)20(23)25-6/h8-9,12,14,18-19H,7,10-11,13H2,1-6H3/t18-,19?,21+,22+/m0/s1
InChIKey CDJVFESJEAWQGP-NDUCAMMLSA-N
Mol Weight 344.5 g/mol
Molecular Formula C22H32O3
Exact Mass 344.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 12WI8InWcq
Name Methyl 7-.beta.-methoxy-dehydroabietate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O3
InChI InChI=1S/C22H32O3/c1-14(2)15-8-9-17-16(12-15)18(24-5)13-19-21(17,3)10-7-11-22(19,4)20(23)25-6/h8-9,12,14,18-19H,7,10-11,13H2,1-6H3/t18-,19?,21+,22+/m0/s1
InChIKey CDJVFESJEAWQGP-NDUCAMMLSA-N
Molecular Weight 344.495 g/mol
SMILES C12[C@@](c3ccc(cc3[C@](C2)(OC)[H])C(C)C)(CCC[C@]1(C(=O)OC)C)C
SPLASH splash10-004r-0963000000-d21d1753ce892114baec
Source of Spectrum OP-25-221-12
Wiley ID 850519