CID 10641

N-methylprotriptyline

Structural Information

Molecular Formula
C20H23N
SMILES
CN(C)CCCC1C2=CC=CC=C2C=CC3=CC=CC=C13
InChI
InChI=1S/C20H23N/c1-21(2)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20/h3-6,8-11,13-14,20H,7,12,15H2,1-2H3
InChIKey
YVBGGZGCBWNVDX-UHFFFAOYSA-N
Compound name
N,N-dimethyl-3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenyl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

14
Patents

277.18304 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.19032 165.3
[M+Na]+ 300.17226 178.2
[M+NH4]+ 295.21686 175.0
[M+K]+ 316.14620 170.0
[M-H]- 276.17576 170.7
[M+Na-2H]- 298.15771 173.2
[M]+ 277.18249 169.0
[M]- 277.18359 169.0
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