CID 154406

74852-62-3

Structural Information

Molecular Formula
C17H21N3O
SMILES
COC1=CC=C(C=C1)N2CCN(CC2)C3=CC=C(C=C3)N
InChI
InChI=1S/C17H21N3O/c1-21-17-8-6-16(7-9-17)20-12-10-19(11-13-20)15-4-2-14(18)3-5-15/h2-9H,10-13,18H2,1H3
InChIKey
VXEGSRKPIUDPQT-UHFFFAOYSA-N
Compound name
4-[4-(4-methoxyphenyl)piperazin-1-yl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

61308
Patents

283.16846 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.175736 168.5
[M+Na]+ 306.157678 173.9
[M-H]- 282.161184 174.3
[M+NH4]+ 301.202283 180.5
[M+K]+ 322.131618 168.8
[M+H-H2O]+ 266.165720 157.8
[M+HCOO]- 328.166661 186.7
[M+CH3COO]- 342.182311 178.2
[M+Na-2H]- 304.143126 171.7
[M]+ 283.16791142 163.5
[M]- 283.16900858 163.5
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