CID 207525

30154-46-2

Structural Information

Molecular Formula
C19H23N
SMILES
CC(C)N1CC2=CC=CC=C2CCC3=CC=CC=C3C1
InChI
InChI=1S/C19H23N/c1-15(2)20-13-18-9-5-3-7-16(18)11-12-17-8-4-6-10-19(17)14-20/h3-10,15H,11-14H2,1-2H3
InChIKey
SMUXDYYZAMXFQY-UHFFFAOYSA-N
Compound name
6-propan-2-yl-5,7,12,13-tetrahydrobenzo[d][2]benzazonine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.18304 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.190316 193.0
[M+Na]+ 288.172258 191.3
[M-H]- 264.175764 191.5
[M+NH4]+ 283.216863 191.8
[M+K]+ 304.146198 190.9
[M+H-H2O]+ 248.180300 183.1
[M+HCOO]- 310.181241 192.5
[M+CH3COO]- 324.196891 193.2
[M+Na-2H]- 286.157706 194.2
[M]+ 265.18249142 192.0
[M]- 265.18358858 192.0
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

No patent data available for this compound.