CID 88358066

Tert-butyl n-(3-amino-2-methoxypropyl)carbamate hydrochloride

Structural Information

Molecular Formula
C9H20N2O3
SMILES
CC(C)(C)OC(=O)NCC(CN)OC
InChI
InChI=1S/C9H20N2O3/c1-9(2,3)14-8(12)11-6-7(5-10)13-4/h7H,5-6,10H2,1-4H3,(H,11,12)
InChIKey
HDQAJSYZUGORCA-UHFFFAOYSA-N
Compound name
tert-butyl N-(3-amino-2-methoxypropyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

204.1474 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.154676 149.2
[M+Na]+ 227.136618 153.9
[M-H]- 203.140124 148.8
[M+NH4]+ 222.181223 167.6
[M+K]+ 243.110558 154.7
[M+H-H2O]+ 187.144660 143.7
[M+HCOO]- 249.145601 170.9
[M+CH3COO]- 263.161251 190.5
[M+Na-2H]- 225.122066 152.3
[M]+ 204.14685142 150.5
[M]- 204.14794858 150.5
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