CID 165999898

Tert-butyl 3-(aminomethyl)-3-(propan-2-yloxy)azetidine-1-carboxylate hydrochloride

Structural Information

Molecular Formula
C12H24N2O3
SMILES
CC(C)OC1(CN(C1)C(=O)OC(C)(C)C)CN
InChI
InChI=1S/C12H24N2O3/c1-9(2)16-12(6-13)7-14(8-12)10(15)17-11(3,4)5/h9H,6-8,13H2,1-5H3
InChIKey
SHMZCUOLNCMQKB-UHFFFAOYSA-N
Compound name
tert-butyl 3-(aminomethyl)-3-propan-2-yloxyazetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.1787 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.185976 164.3
[M+Na]+ 267.167918 167.9
[M-H]- 243.171424 165.6
[M+NH4]+ 262.212523 175.5
[M+K]+ 283.141858 171.3
[M+H-H2O]+ 227.175960 153.7
[M+HCOO]- 289.176901 180.5
[M+CH3COO]- 303.192551 198.8
[M+Na-2H]- 265.153366 165.5
[M]+ 244.17815142 174.2
[M]- 244.17924858 174.2
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.