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(1S,3S,4R)-Methyl 3-(Hydroxymethyl)-4,5,5-trimethyl-cyclopentanecarboxylate
SpectraBase Compound ID BOO0fwt4vqJ
InChI InChI=1S/C11H20O3/c1-7-8(6-12)5-9(10(13)14-4)11(7,2)3/h7-9,12H,5-6H2,1-4H3/t7-,8-,9-/m1/s1
InChIKey MHACXTRBRDZJBY-IWSPIJDZSA-N
Mol Weight 200.28 g/mol
Molecular Formula C11H20O3
Exact Mass 200.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CY60zuJsMNV
Name (1S,3S,4R)-Methyl 3-(Hydroxymethyl)-4,5,5-trimethyl-cyclopentanecarboxylate
CAS Registry Number 127308-42-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O3
InChI InChI=1S/C11H20O3/c1-7-8(6-12)5-9(10(13)14-4)11(7,2)3/h7-9,12H,5-6H2,1-4H3/t7-,8-,9-/m1/s1
InChIKey MHACXTRBRDZJBY-IWSPIJDZSA-N
Molecular Weight 200.278 g/mol
SMILES OC[C@@]1([C@](C([C@](C1)(C(=O)OC)[H])(C)C)(C)[H])[H]
SPLASH splash10-05fr-0900000000-b2a7f2a3d557bb203fbe
Source of Spectrum J-55-4056-10
Synonyms Methyl (1S,3R,4S)-4-(hydroxymethyl)-2,2,3-trimethylcyclopentanecarboxylate
Wiley ID 1197750