CID 43378546

2243505-03-3

Structural Information

Molecular Formula
C14H21N
SMILES
CC(C)(C)C1=CC=C(C=C1)C2(CCC2)N
InChI
InChI=1S/C14H21N/c1-13(2,3)11-5-7-12(8-6-11)14(15)9-4-10-14/h5-8H,4,9-10,15H2,1-3H3
InChIKey
ZENPMQYHXUYRAV-UHFFFAOYSA-N
Compound name
1-(4-tert-butylphenyl)cyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

203.1674 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.17468 149.2
[M+Na]+ 226.15662 156.4
[M+NH4]+ 221.20122 155.7
[M+K]+ 242.13056 149.9
[M-H]- 202.16012 150.6
[M+Na-2H]- 224.14207 155.6
[M]+ 203.16685 149.7
[M]- 203.16795 149.7
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.