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Spiro[2.4]heptane-1-carboxylic acid, 1-chloro-2-phenyl-, 1,1-dimethylethyl ester, cis-
SpectraBase Compound ID 8fLYfXCiZRd
InChI InChI=1S/C18H23ClO2/c1-16(2,3)21-15(20)18(19)14(13-9-5-4-6-10-13)17(18)11-7-8-12-17/h4-6,9-10,14H,7-8,11-12H2,1-3H3/t14-,18-/m0/s1
InChIKey KXMQMFOVLDWVQP-KSSFIOAISA-N
Mol Weight 306.83 g/mol
Molecular Formula C18H23ClO2
Exact Mass 306.138658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EAHh6UMiA0o
Name Spiro[2.4]heptane-1-carboxylic acid, 1-chloro-2-phenyl-, 1,1-dimethylethyl ester, cis-
CAS Registry Number 87957-59-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23ClO2
InChI InChI=1S/C18H23ClO2/c1-16(2,3)21-15(20)18(19)14(13-9-5-4-6-10-13)17(18)11-7-8-12-17/h4-6,9-10,14H,7-8,11-12H2,1-3H3/t14-,18-/m0/s1
InChIKey KXMQMFOVLDWVQP-KSSFIOAISA-N
Molecular Weight 306.833 g/mol
SMILES [C@@]1(C2(CCCC2)[C@@]1(c1ccccc1)[H])(C(OC(C)(C)C)=O)Cl
SPLASH splash10-0gb9-0490000000-0ba7ce051f04a28db61f
Source of Spectrum K-116-3105-0
Synonyms tert-Butyl (1R,2S)-1-chloro-2-phenylspiro[2.4]heptane-1-carboxylate tert-Butylester of 1-chloro-t-2-phenylspiro[2.4]heptan-r-1-carboxylic acid
Wiley ID 1308201