CID 7472

N,n-dimethyl-p-phenylenediamine

Structural Information

Molecular Formula
C8H12N2
SMILES
CN(C)C1=CC=C(C=C1)N
InChI
InChI=1S/C8H12N2/c1-10(2)8-5-3-7(9)4-6-8/h3-6H,9H2,1-2H3
InChIKey
BZORFPDSXLZWJF-UHFFFAOYSA-N
Compound name
4-N,4-N-dimethylbenzene-1,4-diamine
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

62
References

27348
Patents

136.10005 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.10733 127.9
[M+Na]+ 159.08927 139.8
[M+NH4]+ 154.13387 137.4
[M+K]+ 175.06321 133.7
[M-H]- 135.09277 132.1
[M+Na-2H]- 157.07472 135.9
[M]+ 136.09950 130.7
[M]- 136.10060 130.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe