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5-Chloro-2,3-dihydroindole-1-carboxylic acid tert-butyl ester

View entire compound with spectra: 1 MS (GC)

5-Chloro-2,3-dihydroindole-1-carboxylic acid tert-butyl ester
SpectraBase Compound ID 40IVe11dnDg
InChI InChI=1S/C13H16ClNO2/c1-13(2,3)17-12(16)15-7-6-9-8-10(14)4-5-11(9)15/h4-5,8H,6-7H2,1-3H3
InChIKey IHXCTZFQPUKXJO-UHFFFAOYSA-N
Mol Weight 253.73 g/mol
Molecular Formula C13H16ClNO2
Exact Mass 253.086956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AUSsQFasO3R
Name 5-Chloro-2,3-dihydroindole-1-carboxylic acid tert-butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16ClNO2
InChI InChI=1S/C13H16ClNO2/c1-13(2,3)17-12(16)15-7-6-9-8-10(14)4-5-11(9)15/h4-5,8H,6-7H2,1-3H3
InChIKey IHXCTZFQPUKXJO-UHFFFAOYSA-N
Molecular Weight 253.729 g/mol
SMILES C(N1c2c(cc(cc2)Cl)CC1)(OC(C)(C)C)=O
SPLASH splash10-0pba-7910000000-fb5c28afe7112b5a7a98
Source of Spectrum H1-34-1035-1
Synonyms 5-Chloroindoline-1-carboxylic acid tert-butyl ester tert-Butyl 5-chloranyl-2,3-dihydroindole-1-carboxylate tert-Butyl 5-chloro-2,3-dihydroindole-1-carboxylate tert-Butyl 5-chloroindoline-1-carboxylate
Wiley ID 754622