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(1S,2R,3S)-2-(Methoxycarbonyl)-3-phenylcyclopropane-1-carboxylic Acid
SpectraBase Compound ID 58x3HZAGSNR
InChI InChI=1S/C12H12O4/c1-16-12(15)10-8(9(10)11(13)14)7-5-3-2-4-6-7/h2-6,8-10H,1H3,(H,13,14)/t8-,9-,10+/m0/s1
InChIKey NZZYQMPKDZBAIS-LPEHRKFASA-N
Mol Weight 220.22 g/mol
Molecular Formula C12H12O4
Exact Mass 220.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2CVBaDF7omu
Name (1S,2R,3S)-2-(Methoxycarbonyl)-3-phenylcyclopropane-1-carboxylic Acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O4
InChI InChI=1S/C12H12O4/c1-16-12(15)10-8(9(10)11(13)14)7-5-3-2-4-6-7/h2-6,8-10H,1H3,(H,13,14)/t8-,9-,10+/m0/s1
InChIKey NZZYQMPKDZBAIS-LPEHRKFASA-N
Literature Reference DOI 10.1002/hlca.19910740832
Molecular Weight 220.224 g/mol
SMILES OC([C@]1([C@](c2ccccc2)([C@]1(C(=O)OC)[H])[H])[H])=O
SPLASH splash10-014i-2900000000-ce46c18fb13aad05fb7a
Source of Spectrum H-74-1950-6b
Wiley ID 1789387