CID 112928

1,4-naphthalenediamine, n,n-dimethyl-, dihydrochloride

Structural Information

Molecular Formula
C12H14N2
SMILES
CN(C)C1=CC=C(C2=CC=CC=C21)N
InChI
InChI=1S/C12H14N2/c1-14(2)12-8-7-11(13)9-5-3-4-6-10(9)12/h3-8H,13H2,1-2H3
InChIKey
HLHYXKMOBCRCRR-UHFFFAOYSA-N
Compound name
4-N,4-N-dimethylnaphthalene-1,4-diamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

138
Patents

186.11569 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.12297 139.5
[M+Na]+ 209.10491 147.5
[M-H]- 185.10841 145.4
[M+NH4]+ 204.14951 160.6
[M+K]+ 225.07885 145.0
[M+H-H2O]+ 169.11295 133.0
[M+HCOO]- 231.11389 164.9
[M+CH3COO]- 245.12954 192.6
[M+Na-2H]- 207.09036 146.9
[M]+ 186.11514 138.9
[M]- 186.11624 138.9
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