Debug Info

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8nzdaXL66q2
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8nzdaXL66q2
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Mass Spectrum (GC)
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Cyclopenta[c]pyran-4-carboxylic acid, 1,4a,5,6,7,7a-hexahydro-1-methoxy-, (1.alpha.,4a.alpha.,7a.alpha.)-(.+-.)-

View entire compound with spectra: 1 MS (GC)

Cyclopenta[c]pyran-4-carboxylic acid, 1,4a,5,6,7,7a-hexahydro-1-methoxy-, (1.alpha.,4a.alpha.,7a.alpha.)-(.+-.)-
SpectraBase Compound ID 8eCWUMHPTUk
InChI InChI=1S/C10H14O4/c1-13-8-5-14-9(10(11)12)7-4-2-3-6(7)8/h5-7,9H,2-4H2,1H3,(H,11,12)/t6-,7+,9+/m1/s1
InChIKey YAIDXBZXUVKQLF-FJXKBIBVSA-N
Mol Weight 198.22 g/mol
Molecular Formula C10H14O4
Exact Mass 198.089209 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8nzdaXL66q2
Name Cyclopenta[c]pyran-4-carboxylic acid, 1,4a,5,6,7,7a-hexahydro-1-methoxy-, (1.alpha.,4a.alpha.,7a.alpha.)-(.+-.)-
CAS Registry Number 67546-36-5
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O4
InChI InChI=1S/C10H14O4/c1-13-8-5-14-9(10(11)12)7-4-2-3-6(7)8/h5-7,9H,2-4H2,1H3,(H,11,12)/t6-,7+,9+/m1/s1
InChIKey YAIDXBZXUVKQLF-FJXKBIBVSA-N
Molecular Weight 198.218 g/mol
SMILES OC([C@]1(OC=C([C@@]2(CCC[C@]12[H])[H])OC)[H])=O
SPLASH splash10-0002-0900000000-221ae992d8a827d943d1
Source of Spectrum K-111-2434-0
Synonyms (+,-)-1.alpha.-methoxy-1,4a.alpha.,5,6,7,7a.alpha.-hexahydrocyclopenta(c)pyran-carboxylic acid (1S,4aR,7aS)-4-methoxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-carboxylic acid
Wiley ID 1195220
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