CID 203015

Tripropylamine, 3,3-diphenyl-, hydrochloride

Structural Information

Molecular Formula
C21H29N
SMILES
CCCN(CCC)CCC(C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C21H29N/c1-3-16-22(17-4-2)18-15-21(19-11-7-5-8-12-19)20-13-9-6-10-14-20/h5-14,21H,3-4,15-18H2,1-2H3
InChIKey
UONTWBKXQUOTMC-UHFFFAOYSA-N
Compound name
3,3-diphenyl-N,N-dipropylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.23 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.237276 176.7
[M+Na]+ 318.219218 179.2
[M-H]- 294.222724 183.0
[M+NH4]+ 313.263823 191.7
[M+K]+ 334.193158 175.3
[M+H-H2O]+ 278.227260 167.5
[M+HCOO]- 340.228201 199.1
[M+CH3COO]- 354.243851 212.2
[M+Na-2H]- 316.204666 179.2
[M]+ 295.22945142 178.0
[M]- 295.23054858 178.0
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.