CID 28279606

84725-45-1

Structural Information

Molecular Formula
C14H23N3
SMILES
CC(C)(CN1CCN(CC1)C2=CC=CC=C2)N
InChI
InChI=1S/C14H23N3/c1-14(2,15)12-16-8-10-17(11-9-16)13-6-4-3-5-7-13/h3-7H,8-12,15H2,1-2H3
InChIKey
VHBCSGDLYUIWQW-UHFFFAOYSA-N
Compound name
2-methyl-1-(4-phenylpiperazin-1-yl)propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

233.1892 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.196476 158.1
[M+Na]+ 256.178418 162.2
[M-H]- 232.181924 160.4
[M+NH4]+ 251.223023 172.4
[M+K]+ 272.152358 158.6
[M+H-H2O]+ 216.186460 149.3
[M+HCOO]- 278.187401 174.3
[M+CH3COO]- 292.203051 194.1
[M+Na-2H]- 254.163866 162.6
[M]+ 233.18865142 152.1
[M]- 233.18974858 152.1
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.