CID 32053

N-ethyl-n-phenylethylenediamine

Structural Information

Molecular Formula
C10H16N2
SMILES
CCNCCNC1=CC=CC=C1
InChI
InChI=1S/C10H16N2/c1-2-11-8-9-12-10-6-4-3-5-7-10/h3-7,11-12H,2,8-9H2,1H3
InChIKey
TWRYNQMDXKYLPX-UHFFFAOYSA-N
Compound name
N-ethyl-N'-phenylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

164.13135 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.13863 135.8
[M+Na]+ 187.12057 141.1
[M-H]- 163.12407 139.0
[M+NH4]+ 182.16517 155.8
[M+K]+ 203.09451 138.8
[M+H-H2O]+ 147.12861 129.3
[M+HCOO]- 209.12955 162.1
[M+CH3COO]- 223.14520 184.1
[M+Na-2H]- 185.10602 144.2
[M]+ 164.13080 134.6
[M]- 164.13190 134.6
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