CID 215090

1,2-dimethyl-1h-perimidine

Structural Information

Molecular Formula
C13H12N2
SMILES
CC1=NC2=CC=CC3=C2C(=CC=C3)N1C
InChI
InChI=1S/C13H12N2/c1-9-14-11-7-3-5-10-6-4-8-12(13(10)11)15(9)2/h3-8H,1-2H3
InChIKey
STQXWPANZYEXBI-UHFFFAOYSA-N
Compound name
1,2-dimethylperimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

29
Patents

196.10005 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.10733 143.2
[M+Na]+ 219.08927 153.5
[M-H]- 195.09277 145.6
[M+NH4]+ 214.13387 162.8
[M+K]+ 235.06321 148.9
[M+H-H2O]+ 179.09731 135.2
[M+HCOO]- 241.09825 162.0
[M+CH3COO]- 255.11390 156.2
[M+Na-2H]- 217.07472 152.8
[M]+ 196.09950 144.5
[M]- 196.10060 144.5
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