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2-Propenoic acid, 3-(4,5-dihydro-2,4-dimethyl-5-oxazolyl)-, methyl ester, [4.alpha.,5.beta.(E)]-
SpectraBase Compound ID kdKi5xcq1c
InChI InChI=1S/C9H13NO3/c1-6-8(13-7(2)10-6)4-5-9(11)12-3/h4-6,8H,1-3H3/b5-4+/t6-,8-/m1/s1
InChIKey GGQKXNNIWFZRLQ-IPNZIGHJSA-N
Mol Weight 183.21 g/mol
Molecular Formula C9H13NO3
Exact Mass 183.089543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 10hFoNlniUf
Name 2-Propenoic acid, 3-(4,5-dihydro-2,4-dimethyl-5-oxazolyl)-, methyl ester, [4.alpha.,5.beta.(E)]-
Alternate Name(s) Methyl (2E)-3-[(4R,5R)-2,4-dimethyl-4,5-dihydro-1,3-oxazol-5-yl]-2-propenoate Methylester of (E)-3-(2,4-dimethyl-2-oxazolin-5-yl)-2-propenic acid
CAS Registry Number 70475-61-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13NO3
InChI InChI=1S/C9H13NO3/c1-6-8(13-7(2)10-6)4-5-9(11)12-3/h4-6,8H,1-3H3/b5-4+/t6-,8-/m1/s1
InChIKey GGQKXNNIWFZRLQ-IPNZIGHJSA-N
Molecular Weight 183.207 g/mol
SMILES C1(=N[C@@]([C@](O1)(\C=C\C(=O)OC)[H])(C)[H])C
SPLASH splash10-001d-9500000000-c8b614ed9d468dbd7d78
Source of Spectrum K-112-817-0
Wiley ID 1179621