CID 18476131

T-butyl 3-amino-2,3-dihydrospiro[indene-1,4'-piperidine]-1'-carboxylate hydrochloride

Structural Information

Molecular Formula
C18H26N2O2
SMILES
CC(C)(C)OC(=O)N1CCC2(CC1)CC(C3=CC=CC=C23)N
InChI
InChI=1S/C18H26N2O2/c1-17(2,3)22-16(21)20-10-8-18(9-11-20)12-15(19)13-6-4-5-7-14(13)18/h4-7,15H,8-12,19H2,1-3H3
InChIKey
MRMIQWNSSBRSLQ-UHFFFAOYSA-N
Compound name
tert-butyl 1-aminospiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

302.19943 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.20671 175.0
[M+Na]+ 325.18865 180.3
[M-H]- 301.19215 179.0
[M+NH4]+ 320.23325 193.5
[M+K]+ 341.16259 176.7
[M+H-H2O]+ 285.19669 168.2
[M+HCOO]- 347.19763 189.9
[M+CH3COO]- 361.21328 204.5
[M+Na-2H]- 323.17410 177.1
[M]+ 302.19888 170.8
[M]- 302.19998 170.8
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