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Bicyclo[7.3.1]trideca-4,9-diene-2,6-diyne-11,13-dione, 1,8-dihydroxy-, [1R-(1R*,4Z,8S*)]-
SpectraBase Compound ID IawwBTrgKm5
InChI InChI=1S/C13H8O4/c14-9-7-10-11(15)5-3-1-2-4-6-13(17,8-9)12(10)16/h1-2,7,11,15,17H,8H2/b2-1-
InChIKey ARKCEWZPKPGESW-UPHRSURJSA-N
Mol Weight 228.2 g/mol
Molecular Formula C13H8O4
Exact Mass 228.042259 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D6Wef0BXEXX
Name Bicyclo[7.3.1]trideca-4,9-diene-2,6-diyne-11,13-dione, 1,8-dihydroxy-, [1R-(1R*,4Z,8S*)]-
Alternate Name(s) 1,8-Dihydroxybicyclo[7.3.1]trideca-4,9-diene-2,6-diyne-11,13-dione (5Z)-2,9-dihydroxybicyclo[7.3.1]trideca-1(12),5-dien-3,7-diyne-11,13-dione (5Z)-2,9-bis(oxidanyl)bicyclo[7.3.1]trideca-1(12),5-dien-3,7-diyne-11,13-dione
CAS Registry Number 134527-52-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H8O4
InChI InChI=1S/C13H8O4/c14-9-7-10-11(15)5-3-1-2-4-6-13(17,8-9)12(10)16/h1-2,7,11,15,17H,8H2/b2-1-
InChIKey ARKCEWZPKPGESW-UPHRSURJSA-N
Molecular Weight 228.203 g/mol
SMILES OC1C=2C(C(CC(C2)=O)(C#C\C=C/C#C1)O)=O
SPLASH splash10-016r-0910000000-1a8c2a057b9d5d5d43de
Source of Spectrum C-113-3866-123
Wiley ID 1229645