CID 36635

Brn 2944467

Structural Information

Molecular Formula
C19H21N
SMILES
CN(C)CC1=CC=CC2=C1C(=C)C3=CC=CC=C3CC2
InChI
InChI=1S/C19H21N/c1-14-18-10-5-4-7-15(18)11-12-16-8-6-9-17(19(14)16)13-20(2)3/h4-10H,1,11-13H2,2-3H3
InChIKey
ZPQFIXNNRGCZCM-UHFFFAOYSA-N
Compound name
N,N-dimethyl-1-(2-methylidene-4-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.1674 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.17468 161.2
[M+Na]+ 286.15662 173.8
[M+NH4]+ 281.20122 170.7
[M+K]+ 302.13056 166.1
[M-H]- 262.16012 166.2
[M+Na-2H]- 284.14207 168.2
[M]+ 263.16685 164.6
[M]- 263.16795 164.6
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

No patent data available for this compound.