CID 120445

Butylamine, n,n-dimethyl-4,4-diphenyl-, hydrochloride

Structural Information

Molecular Formula
C18H23N
SMILES
CN(C)CCCC(C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C18H23N/c1-19(2)15-9-14-18(16-10-5-3-6-11-16)17-12-7-4-8-13-17/h3-8,10-13,18H,9,14-15H2,1-2H3
InChIKey
BDSUMBDGCUOHGR-UHFFFAOYSA-N
Compound name
N,N-dimethyl-4,4-diphenylbutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

4
Patents

253.18304 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.19032 162.8
[M+Na]+ 276.17226 166.6
[M-H]- 252.17576 169.7
[M+NH4]+ 271.21686 179.5
[M+K]+ 292.14620 163.5
[M+H-H2O]+ 236.18030 154.2
[M+HCOO]- 298.18124 186.3
[M+CH3COO]- 312.19689 203.3
[M+Na-2H]- 274.15771 167.0
[M]+ 253.18249 163.1
[M]- 253.18359 163.1
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.