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(Sa,R)-(+)-2-Methylhepta-3,4-dienoic Acid

View entire compound with spectra: 1 MS (GC)

(Sa,R)-(+)-2-Methylhepta-3,4-dienoic Acid
SpectraBase Compound ID HrN3Ep0AhDb
InChI InChI=1S/C8H12O2/c1-3-4-5-6-7(2)8(9)10/h4,6-7H,3H2,1-2H3,(H,9,10)/t5?,7-/m1/s1
InChIKey NSQBTIVYVYZGSF-NQPNHJOESA-N
Mol Weight 140.18 g/mol
Molecular Formula C8H12O2
Exact Mass 140.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Q3dafVuu7q
Name (Sa,R)-(+)-2-Methylhepta-3,4-dienoic Acid
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O2
InChI InChI=1S/C8H12O2/c1-3-4-5-6-7(2)8(9)10/h4,6-7H,3H2,1-2H3,(H,9,10)/t5?,7-/m1/s1
InChIKey NSQBTIVYVYZGSF-NQPNHJOESA-N
Molecular Weight 140.182 g/mol
SMILES OC(=O)[C@@](C=C=CCC)(C)[H]
SPLASH splash10-004i-0900000000-332d08bebee95a3e2c3f
Source of Spectrum U1-2010-691-12
Wiley ID 1663338