CID 47486

3,3-diphenylcyclobutylamine hydrochloride

Structural Information

Molecular Formula
C16H17N
SMILES
C1C(CC1(C2=CC=CC=C2)C3=CC=CC=C3)N
InChI
InChI=1S/C16H17N/c17-15-11-16(12-15,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15H,11-12,17H2
InChIKey
IABBZBVTZRKDFW-UHFFFAOYSA-N
Compound name
3,3-diphenylcyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

223.1361 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.14338 150.2
[M+Na]+ 246.12532 155.9
[M-H]- 222.12882 159.2
[M+NH4]+ 241.16992 163.2
[M+K]+ 262.09926 154.4
[M+H-H2O]+ 206.13336 137.7
[M+HCOO]- 268.13430 172.7
[M+CH3COO]- 282.14995 162.2
[M+Na-2H]- 244.11077 156.4
[M]+ 223.13555 154.9
[M]- 223.13665 154.9
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

patents stripe