CID 510122

Tert-butyl n-[2-(4,7-dimethoxyindol-1-yl)ethyl]carbamate

Structural Information

Molecular Formula
C17H24N2O4
SMILES
CC(C)(C)OC(=O)NCCN1C=CC2=C(C=CC(=C21)OC)OC
InChI
InChI=1S/C17H24N2O4/c1-17(2,3)23-16(20)18-9-11-19-10-8-12-13(21-4)6-7-14(22-5)15(12)19/h6-8,10H,9,11H2,1-5H3,(H,18,20)
InChIKey
DUDPBMLRAOPQDS-UHFFFAOYSA-N
Compound name
tert-butyl N-[2-(4,7-dimethoxyindol-1-yl)ethyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

320.1736 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.18088 176.9
[M+Na]+ 343.16282 185.1
[M-H]- 319.16632 180.8
[M+NH4]+ 338.20742 193.3
[M+K]+ 359.13676 183.2
[M+H-H2O]+ 303.17086 170.0
[M+HCOO]- 365.17180 199.0
[M+CH3COO]- 379.18745 210.1
[M+Na-2H]- 341.14827 180.9
[M]+ 320.17305 185.3
[M]- 320.17415 185.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.