CID 3014066

(dimethylaminomethylene)dimethylammonium chloride

Structural Information

Molecular Formula
C5H13N2
SMILES
CN(C)C=[N+](C)C
InChI
InChI=1S/C5H13N2/c1-6(2)5-7(3)4/h5H,1-4H3/q+1
InChIKey
NSPYNFGENNBEKB-UHFFFAOYSA-N
Compound name
dimethylaminomethylidene(dimethyl)azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

186
Patents

101.10787 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 102.11515 119.3
[M+Na]+ 124.09709 126.1
[M-H]- 100.10059 123.1
[M+NH4]+ 119.14169 143.2
[M+K]+ 140.07103 123.0
[M+H-H2O]+ 84.105130 117.1
[M+HCOO]- 146.10607 146.4
[M+CH3COO]- 160.12172 172.5
[M+Na-2H]- 122.08254 128.2
[M]+ 101.10732 119.0
[M]- 101.10842 119.0
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