SpectraBase Spectrum ID |
6NV1RQCDPSX |
Name |
exo-5-Aminomethylbicyclo-[2.2.1]-hept-2-ene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
123.104799423 u |
Formula |
C8H13N |
InChI |
InChI=1S/C8H13N/c9-5-8-4-6-1-2-7(8)3-6/h1-2,6-8H,3-5,9H2/t6-,7+,8-/m1/s1 |
InChIKey |
XLBALIGLOMYEKN-GJMOJQLCSA-N |
Molecular Weight |
123.199 g/mol |
SMILES |
C(N)[C@@]1([C@@]2(C[C@@](C=C2)(C1)[H])[H])[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.961318 |