For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Bicyclo[3.1.1]heptane-1-carboxylic acid, 5-(bromomethyl)-, 1,1-dimethylethyl ester
SpectraBase Compound ID 19BfZJcewU6
InChI InChI=1S/C13H21BrO2/c1-11(2,3)16-10(15)13-6-4-5-12(7-13,8-13)9-14/h4-9H2,1-3H3
InChIKey JLAGYTPMCPUCFQ-UHFFFAOYSA-N
Mol Weight 289.21 g/mol
Molecular Formula C13H21BrO2
Exact Mass 288.072493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2O5DvqQ7Kym
Name Bicyclo[3.1.1]heptane-1-carboxylic acid, 5-(bromomethyl)-, 1,1-dimethylethyl ester
Alternate Name(s) tert-Butyl 5-(bromomethyl)bicyclo[3.1.1]heptane-1-carboxylate
CAS Registry Number 122699-69-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H21BrO2
InChI InChI=1S/C13H21BrO2/c1-11(2,3)16-10(15)13-6-4-5-12(7-13,8-13)9-14/h4-9H2,1-3H3
InChIKey JLAGYTPMCPUCFQ-UHFFFAOYSA-N
Molecular Weight 289.213 g/mol
SMILES C12(C(OC(C)(C)C)=O)CC(C2)(CBr)CCC1
SPLASH splash10-0pb9-3900000000-054271c2aa6ee4d89032
Source of Spectrum J-54-4949-29
Wiley ID 1291426