SpectraBase Spectrum ID |
8vWurBKKQYP |
Name |
Tricyclo[4.1.0.02,7]hept-4-en-3-ol, 3,5-dinitrobenzoate |
Alternate Name(s) |
3,5-Dinitrobenzoat
tricyclo[4.1.0.0(2,7)]hept-4-en-3-yl 3,5-dinitrobenzoate |
CAS Registry Number |
59574-43-5 |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C14H10N2O6 |
InChI |
InChI=1S/C14H10N2O6/c17-14(22-10-2-1-9-11-12(9)13(10)11)6-3-7(15(18)19)5-8(4-6)16(20)21/h1-5,9-13H |
InChIKey |
OCFHPLMGJWNFEF-UHFFFAOYSA-N |
Molecular Weight |
302.242 g/mol |
SMILES |
C12C3C2C(OC(c2cc(N(=O)=O)cc(N(=O)=O)c2)=O)C=CC13 |
SPLASH |
splash10-004i-9000000000-1bbb462f355616183110 |
Source of Spectrum |
K-119-153-29 |
Wiley ID |
1304320 |