CID 80559460

N1-phenylcyclobutane-1,3-diamine hydrochloride

Structural Information

Molecular Formula
C10H14N2
SMILES
C1C(CC1NC2=CC=CC=C2)N
InChI
InChI=1S/C10H14N2/c11-8-6-10(7-8)12-9-4-2-1-3-5-9/h1-5,8,10,12H,6-7,11H2
InChIKey
GBSQTJGURRRNCR-UHFFFAOYSA-N
Compound name
1-N-phenylcyclobutane-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

162.11569 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.12297 136.2
[M+Na]+ 185.10491 143.0
[M+NH4]+ 180.14951 141.6
[M+K]+ 201.07885 138.3
[M-H]- 161.10841 138.6
[M+Na-2H]- 183.09036 141.8
[M]+ 162.11514 136.5
[M]- 162.11624 136.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.