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Secostrychnosin
SpectraBase Compound ID EfDKUOFLRze
InChI InChI=1S/C10H12O3/c1-2-7-5-12-6-9-8(7)3-4-13-10(9)11/h2,6-8H,1,3-5H2/t7-,8-/m0/s1
InChIKey UOMUHNNOLZVNSH-YUMQZZPRSA-N
Mol Weight 180.2 g/mol
Molecular Formula C10H12O3
Exact Mass 180.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lp5nMFLC09J
Name Secostrychnosin
Alternate Name(s) (4aS,5R)-5-vinyl-4,4a,5,6-tetrahydro-1H,3H-pyrano[3,4-c]pyran-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O3
InChI InChI=1S/C10H12O3/c1-2-7-5-12-6-9-8(7)3-4-13-10(9)11/h2,6-8H,1,3-5H2/t7-,8-/m0/s1
InChIKey UOMUHNNOLZVNSH-YUMQZZPRSA-N
Literature Reference DOI 10.1002/jccs.200100038
Molecular Weight 180.203 g/mol
SMILES C1C[C@]2([C@](COC=C2C(O1)=O)(C=C)[H])[H]
SPLASH splash10-0089-3900000000-94e19f61f73cd20f79e8
Source of Spectrum QA-48-237-1
Wiley ID 1795330