CID 18337536

944906-95-0

Structural Information

Molecular Formula
C14H20N2O2
SMILES
CC(C)(C)OC(=O)N1CCC(C2=CC=CC=C21)N
InChI
InChI=1S/C14H20N2O2/c1-14(2,3)18-13(17)16-9-8-11(15)10-6-4-5-7-12(10)16/h4-7,11H,8-9,15H2,1-3H3
InChIKey
SBMGKXNAGCGTTA-UHFFFAOYSA-N
Compound name
tert-butyl 4-amino-3,4-dihydro-2H-quinoline-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

248.15248 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.159756 159.1
[M+Na]+ 271.141698 165.3
[M-H]- 247.145204 161.4
[M+NH4]+ 266.186303 175.9
[M+K]+ 287.115638 162.8
[M+H-H2O]+ 231.149740 152.3
[M+HCOO]- 293.150681 176.1
[M+CH3COO]- 307.166331 196.2
[M+Na-2H]- 269.127146 163.5
[M]+ 248.15193142 157.1
[M]- 248.15302858 157.1
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