CID 370767

Nsc644290

Structural Information

Molecular Formula
C15H22N2O
SMILES
CC(C)(COC)N=CN1CCC2=CC=CC=C2C1
InChI
InChI=1S/C15H22N2O/c1-15(2,11-18-3)16-12-17-9-8-13-6-4-5-7-14(13)10-17/h4-7,12H,8-11H2,1-3H3
InChIKey
JUCLUJNQRODAFH-UHFFFAOYSA-N
Compound name
1-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(1-methoxy-2-methylpropan-2-yl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

246.17322 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.180496 159.3
[M+Na]+ 269.162438 164.7
[M-H]- 245.165944 162.7
[M+NH4]+ 264.207043 176.8
[M+K]+ 285.136378 162.0
[M+H-H2O]+ 229.170480 151.6
[M+HCOO]- 291.171421 178.9
[M+CH3COO]- 305.187071 199.6
[M+Na-2H]- 267.147886 166.4
[M]+ 246.17267142 159.4
[M]- 246.17376858 159.4
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.