CID 276346

Cuban-1-ylmethanamine hydrochloride

Structural Information

Molecular Formula
C9H11N
SMILES
C(C12C3C4C1C5C4C3C25)N
InChI
InChI=1S/C9H11N/c10-1-9-6-3-2-4(6)8(9)5(2)7(3)9/h2-8H,1,10H2
InChIKey
CRHYPLCALPANOH-UHFFFAOYSA-N
Compound name
cuban-1-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

11
Patents

133.08914 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.09642 207.0
[M+Na]+ 156.07836 202.1
[M+NH4]+ 151.12296 203.3
[M+K]+ 172.05230 200.5
[M-H]- 132.08186 202.9
[M+Na-2H]- 154.06381 199.4
[M]+ 133.08859 203.2
[M]- 133.08969 203.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe