CID 112756440

Tert-butyl n-{2h,3h-furo[3,2-b]pyridin-3-yl}carbamate

Structural Information

Molecular Formula
C12H16N2O3
SMILES
CC(C)(C)OC(=O)NC1COC2=C1N=CC=C2
InChI
InChI=1S/C12H16N2O3/c1-12(2,3)17-11(15)14-8-7-16-9-5-4-6-13-10(8)9/h4-6,8H,7H2,1-3H3,(H,14,15)
InChIKey
MMMKQDVFOHNLQU-UHFFFAOYSA-N
Compound name
tert-butyl N-(2,3-dihydrofuro[3,2-b]pyridin-3-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

236.11609 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.123366 153.2
[M+Na]+ 259.105308 160.2
[M-H]- 235.108814 157.0
[M+NH4]+ 254.149913 171.0
[M+K]+ 275.079248 159.9
[M+H-H2O]+ 219.113350 147.0
[M+HCOO]- 281.114291 173.1
[M+CH3COO]- 295.129941 191.3
[M+Na-2H]- 257.090756 159.8
[M]+ 236.11554142 155.3
[M]- 236.11663858 155.3
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.