CID 199751

Cyclohexylamine, 4-(10,11-dihydro-5h-dibenz(a,d)cyclohepten-5-yl)-n,n-dimethyl-

Structural Information

Molecular Formula
C23H29N
SMILES
CN(C)C1CCC(CC1)C2C3=CC=CC=C3CCC4=CC=CC=C24
InChI
InChI=1S/C23H29N/c1-24(2)20-15-13-19(14-16-20)23-21-9-5-3-7-17(21)11-12-18-8-4-6-10-22(18)23/h3-10,19-20,23H,11-16H2,1-2H3
InChIKey
QOTYDWYDOFVHGZ-UHFFFAOYSA-N
Compound name
N,N-dimethyl-4-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyl)cyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

319.23 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.23728 177.9
[M+Na]+ 342.21922 180.5
[M-H]- 318.22272 186.8
[M+NH4]+ 337.26382 193.3
[M+K]+ 358.19316 179.1
[M+H-H2O]+ 302.22726 171.0
[M+HCOO]- 364.22820 194.0
[M+CH3COO]- 378.24385 187.0
[M+Na-2H]- 340.20467 180.2
[M]+ 319.22945 170.5
[M]- 319.23055 170.5
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