CID 256312

2428-22-0

Structural Information

Molecular Formula
C14H15N
SMILES
CN(C)C1=CC=C(C=C1)C=C2C=CC=C2
InChI
InChI=1S/C14H15N/c1-15(2)14-9-7-13(8-10-14)11-12-5-3-4-6-12/h3-11H,1-2H3
InChIKey
FIXQBRDVPNLSGD-UHFFFAOYSA-N
Compound name
4-(cyclopenta-2,4-dien-1-ylidenemethyl)-N,N-dimethylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

3
Patents

197.12045 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.12773 144.6
[M+Na]+ 220.10967 151.8
[M-H]- 196.11317 152.9
[M+NH4]+ 215.15427 166.1
[M+K]+ 236.08361 148.8
[M+H-H2O]+ 180.11771 137.6
[M+HCOO]- 242.11865 171.6
[M+CH3COO]- 256.13430 189.9
[M+Na-2H]- 218.09512 149.1
[M]+ 197.11990 144.7
[M]- 197.12100 144.7
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